Zeitschrift für Kristallographie - New Crystal Structures

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Volume 231, Issue 4

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Zeitschrift für Kristallographie - New Crystal Structures

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Cover and Frontmatter

October 4, 2016

Page range: i-vii

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Open Access
Crystal structure of the catena-poly-[bis(μ₂-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl-κN)-1,4-dihydroquinoline-3-carboxylato-κ²O,O′)nickel(II)] 5.5 hydrate, C₃₂H₄₄N₆NiO₁₁F₂

August 10, 2016

Zhe An, Ling Zhu, Xin-Hua Zhao

Page range: 1007-1008

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C 32 H 44 N 6 NiO 11 F 2 , monoclinic, P 2/ c (no. 13), a = 10.4372(5)Å, b = 11.4647(5) Å, c = 17.0628(10) Å, β = 122.508(4)°, V = 1721.82(15) Å 3 , Z = 2, R gt ( F ) = 0.0509, wR ref ( F 2 ) = 0.1380, T = 293(2) K.
Open Access
Crystal structure of catena-poly-[(μ₂-2-(2-((2,6-dimethylphenyl)amino)phenyl)acetato-κ²O:O′)(μ₂-2-(2-((2,6-dimethylphenyl)amino)phenyl)acetate-κ³O,O′:O′)cadmium(II)], C₂₈H₂₀N₂Cl₄O₄Cd

June 22, 2016

Shi-Hui Li, Yan Zhao, Li Zhang

Page range: 1009-1011

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C 28 H 20 N 2 Cl 4 O 4 Cd, monoclinic, P 2 1 / c (no. 14), a = 12.5272(4) Å, b = 28.7754(10) Å, c = 7.7485(3) Å, β = 96.627(1)°, V = 2774.48(17) Å 3 , Z = 4, R gt ( F ) = 0.0341, wR ref ( F 2 ) = 0.0787, T = 296(2) K.
Open Access
Crystal structure of catena-poly[dichlorido-(μ₂-4-(pyridin-4-yl)-isophthalate-κ²O, O′)cadmium(II)] monohydrate, C₁₃H₁₁NO₅Cl₂Cd

August 10, 2016

Shi-Hui Li, Min Zheng

Page range: 1013-1014

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C 13 H 11 N 1 O 5 Cl 2 Cd, monoclinic, P 2 1 (no. 4), a = 8.036(4) Å, b = 7.113(3) Å, c = 13.556(6) Å, β = 104.725(5)°, V = 749.5(6) Å 3 , Z = 2, R gt ( F ) = 0.0220, wR ref ( F 2 ) = 0.0562, T = 296(2) K.
Open Access
Crystal structure of poly-{[μ₂-(E)-1,4-di(1H-imidazol-1-yl)but-2-ene-κ²N:N′][μ₂-cyclohexane-1,4-dicarboxylato-κ⁴O,O′:O′′,O′′′]nickel(II)}, C₁₈H₂₂N₄NiO₄

May 19, 2016

Wei Li, Xuan Sun, Jian Suo, Yanpeng Xing, Daguang Wang

Page range: 1015-1016

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C 18 H 22 N 4 NiO 4 , orthorhombic, Pna 2 1 (no. 33), a = 8.9924(5) Å, b = 17.1818(10) Å, c = 12.1009(7) Å, V = 1869.66(19) Å 3 , Z = 4, R gt (F) = 0.0328, wR ref (F 2 ) = 0.0798, T = 293 K.
Open Access
Crystal structure of aqua (5,5′-dicarboxy-(1,1′-biphenyl)-2,3′-dicarboxylato-κO) bis(1,10-phenanthroline-κ²N,N′)cadmium monohydrate, C₄₀H₂₈CdN₄O₁₀

June 1, 2016

Li-Ping Yao, Yan Zhao, Rui Zhang

Page range: 1017-1019

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C 40 H 28 N 4 O 10 Cd, monoclinic, P 2 1 / c (no. 14), a = 9.5953(8) Å, b = 22.1448(17) Å, c = 16.3937(13) Å, β = 90.528(1)°, V = 3483.3(5) Å 3 , Z = 4, R gt (F) = 0.068, wR ref (F 2 ) = 0.1343, T = 296(2) K.
Open Access
Crystal structure of 5-methoxy-N′-[(3Z)-5-chloro-1-(4-fluorobenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-indole-2-carbohydrazide-DMSO (1/1), C₂₅H₁₈ClFN₄O₃ · C₂H₆OS

June 2, 2016

Nadia G. Haress, Hazem A. Ghabbour, Maha S. Almutairi, Hoong-Kun Fun, Mohamed I. Attia

Page range: 1021-1023

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C 25 H 18 ClFN 4 O 3 · C 2 H 6 OS, monoclinic, P 2 1 (No. 4), a = 6.0486(2) Å, b = 17.4704(7) Å, c = 11.9215(4) Å, β = 96.327(1)°, V = 1252.09(8) Å 3 , Z = 2, R gt (F) = 0.0476, wR ref (F 2 ) = 0.1004, T = 100 K.
Open Access
Crystal structure of 5-methoxy-N′-[(3Z)-1-benzyl-5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-indole-2-carbohydrazide-DMSO (1/1), C₂₇H₂₅FN₄O₄S

June 1, 2016

Maha S. Almutairi, Hazem A. Ghabbour, Nadia G. Haress, Mohamed I. Attia

Page range: 1025-1027

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C 27 H 25 FN 4 O 4 S, triclinic, P 1̅, a = 10.1996(5) Å, b = 11.4836(6) Å, c = 12.1907(8) Å, α = 100.728(2)°, β = 100.807(2)°, γ = 114.612(2)°, V = 1218.03(12) Å 3 , Z = 2, R gt (F) = 0.0542, wR ref (F 2 ) = 0.1319, T = 100 K.
Open Access
Crystal structure of poly-[bis{μ₂-N-(4-(1H-imidazol-1-yl)phenyl)-4-(1H-imidazol-1-yl)-N-phenylaniline-κ²N:N′)}-(μ₂-naphthalene-2,6-dicarboxylato)-(μ₄-naphthalene-2,6-dicarboxylato)dicadmium(II)], C₃₆H₂₅N₅O₄Cd

June 14, 2016

Helong Bai, Ping Zhang

Page range: 1029-1031

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C 36 H 25 N 5 O 4 Cd, monoclinic, P 1̅ (No. 2), a = 9.708(5) Å, b = 10.954(5) Å, c = 15.014(5) Å, α = 97.858(5)°, β = 98.584(5)°, γ = 104.798(5)°, V = 1500.6(11) Å 3 , Z = 2, R gt (F) = 0.0297, wR ref (F 2 ) = 0.0904, T = 293(2) K.
Open Access
Crystal structure of 1-(adamantan-1-yl)-3-(4-bromophenyl)thiourea, C₁₇H₂₁BrN₂S

June 15, 2016

Fatmah A. M. Al-Omary, Lamees S. Al-Rasheed, Hazem A. Ghabbour, Ali A. El-Emam

Page range: 1033-1035

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C 17 H 21 BrN 2 S, orthorhombic, Pbca (No. 61), a = 17.0675(7) Å, b = 8.3422(3) Å, c = 22.5970(8) Å, V = 3217.4(2) Å 3 , Z = 8, R gt (F) = 0.0329, wR ref (F 2 ) = 0.0724, T = 100 K.
Open Access
Crystal structure of N′-[(1E)-(2,6-dichlorophenyl)-methylidene]adamantane-1-carbohydrazide, C₁₈H₂₀Cl₂N₂O

June 20, 2016

Haya I. Aljohar, Hazem A. Ghabbour, Mohammed S.M. Abdelbaky, Santiago Garcia-Granda, Ali A. El-Emam

Page range: 1037-1039

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C 18 H 20 Cl 2 N 2 O, orthorhombic, Pbca (No. 61), a = 8.1023(2) Å, b = 18.7063(4) Å, c = 22.5509(6) Å, V = 3417.91(14) Å 3 , Z = 8, R gt ( F ) = 0.0496, wR ref ( F 2 ) = 0.1535, T = 293(2).
Open Access
Crystal structure of dichlorido{bis(2-hydroxyethyl)-5′-([2,2′:6′,2′′-terpyridin]-4′-yl)-[1,1′:3′,1′′-terphenyl]-4,4′′-dicarboxylate-κ³N,N′,N′′}zinc(II), C₃₉H₃₁C_l2N₃O₆Zn

July 6, 2016

Yaping Li, Dajun Sun, Julia Ming, Guanfang Su

Page range: 1041-1042

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C 39 H 31 C l2 N 3 O 6 Zn, monoclinic, C 2/ c (no. 15), a = 20.7170(16) Å, b = 14.4553(11) Å, c = 11.2717(8) Å, β = 90.072(2)°, V = 3375.5(4) Å 3 , Z = 4, R gt (F) = 0.0489, wR ref (F 2 ) = 0.1469, T = 293(2) K.
Open Access
Crystal structure of 4,4′-(1,3,5,7-tetraoxo-3a,4,4a,5,7,7a,8,8a-octahydro-4,8-ethenopyrrolo [3,4-f]isoindole-2,6(1H,3H)-diyl)dibenzoic acid, C₂₆H₁₈N₂O₈

June 1, 2016

Yaping Li, Dajun Sun, Julia Ming, Guanfang Su

Page range: 1043-1044

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C 26 H 18 N 2 O 8 , triclinic, P 1̅ (no. 2), a = 7.7679(19) Å, b = 11.000(3) Å, c = 13.370(3) Å, α = 75.682(5)°, β = 81.286(5)°, γ = 69.905(5)°, V = 1036.7(5) Å 3 , Z = 2, R gt (F) = 0.0643, wR ref ( F 2 ) = 0.1680, T = 293(2) K.
Open Access
Crystal structure of (E)-1-(4-(((E)-3,5-dichloro-2-hydroxybenzylidene)amino)phenyl)ethan-1-one O-ethyl oxime, C₁₇H₁₆Cl₂N₂O₂

June 20, 2016

Li Zhao, Fei Wang, Qin-Qin An, Ji-Xing Zhao

Page range: 1045-1046

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C 17 H 16 Cl 2 N 2 O 2 , monoclinic, P 2 1 / c (no. 14), a = 9.1238(5) Å, b = 13.0575(4) Å, c = 14.3740(5) Å, β = 104.616(4)°, V = 1657.02(11) Å 3 , Z = 4, R gt ( F ) = 0.0460, wR ref ( F 2 ) = 0.1120, T = 293(2) K.
Open Access
The crystal structure of diaqua-(N-(2-hydroxy-5-nitrobenzyl)iminodiacetato-κ⁴-N,O,O′,O′′)chromium(III) based on synchrotron data, C₁₁H₁₃CrN₂O₉

June 11, 2016

Ling Xie, Sisi Feng, Liping Lu, Miaoli Zhu

Page range: 1047-1049

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C 11 H 13 CrN 2 O 9 , orthorhombic, Pbca (no. 61), a = 6.7740(14) Å, b = 12.309(3) Å, c = 32.776(7) Å, V = 2732.9(10) Å 3 , Z = 8, R gt ( F ) = 0.0302, wR ref ( F 2 ) = 0.0867, T = 100(2) K.
Open Access
Crystal structure of ethyl 5-amino-3-(methylthio)-1-(1-phenyl-5-(thiophen-2-yl)-1H-pyrazole-3-carbonyl)-1H-pyrazole-4-carboxylate, C₂₁H₁₉N₅O₃S₂

June 1, 2016

Gamal A. El-Hiti, Bakr F. Abdel-Wahab, Mohammed Baashen, Hazem A. Ghabbour

Page range: 1051-1052

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C 21 H 19 N 5 O 3 S 2 , monoclinic, P 2 1 / c (No. 14), a = 24.7576(12) Å, b = 5.0596(2) Å, c = 16.9165(8) Å, β = 101.630(2)°, V = 2075.52(16) Å 3 , Z = 4, R gt (F) = 0.0427, wR ref (F 2 ) = 0.1040, T = 100 K.
Open Access
Crystal structure of (E)-1-(4-(((E)-3,5-dibromo-2-hydroxybenzylidene)amino)phenyl)ethan-1-one O-methyl oxime, C₁₇H₁₆Br₂N₂O₂

June 22, 2016

Li Zhao, Ji-Xing Zhao, Qin-Qin An, Fei Wang

Page range: 1053-1054

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C 17 H 16 Br 2 N 2 O 2 , monoclinic, P 2 1 / c (no. 14), a = 9.2648(14) Å, b = 13.3034(16) Å, c = 14.510(2) Å, β = 105.261(15)°, V = 1725.4(4) Å 3 , Z = 4, R gt (F) = 0.0679, wR ref (F 2 ) = 0.1657, T = 293(2) K.
Open Access
Crystal structure of dibromido μ-oxalato-κ²O,O′:κ²O′′,O′′′−η⁶-p-cymenediosmium(II), C₂₂H₂₈Br₂O₄Os₂

September 9, 2016

Hadley S. Clayton, Kgaugelo C. Tapala, Andreas Lemmerer

Page range: 1055-1056

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C 22 H 28 Br 2 O 4 Os 2 , orthorhombic, Pbca (no. 61), a = 10.8433(5)Å, b = 11.8395(5) Å, c = 18.7871(8) Å, V = 2411.87(18) Å 3 , Z = 4, R gt ( F ) = 0.0511, wR ref ( F 2 ) = 0.1061, T = 173 K.
Open Access
Crystal structure of 2-(bromomethyl)-4-(4-chlorophenyl)-1-tosylpyrrolidine, C₁₈H₁₉BrClNO₂S₂

June 1, 2016

Jingfang Zhang, Yulong Liu, Gereltu Borjihan, Wei He

Page range: 1057-1058

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C 18 H 19 BrClNO 2 S 2 , monoclinic, P 2 1 / c (no. 14), a = 21.324(6) Å, b = 5.8597(16) Å, c = 14.966(4) Å, β = 95.558(5)°, V = 1861.2(9) Å 3 , Z = 4, R gt (F) = 0.0454, wR ref (F 2 ) = 0.1258, T = 296(2) K.
Open Access
Crystal structure of 5-(3-fluorobenzylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione; C₁₃H₁₁FN₂O₃

June 15, 2016

Assem Barakat, Hazem A. Ghabbour, Bandar M. Al-Qahtani, M. Ali, Abdullah Mohammed Al-Majid

Page range: 1059-1061

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C 13 H 11 FN 2 O 3 , triclinic, P 1̅, a = 5.7471(4) Å, b = 7.8734(6) Å, c = 13.3112(11) Å, α = 75.546(3)°, β = 78.183(3)°, γ = 77.540(3)°, V = 562.22(7) Å 3 , Z = 2, R gt (F) = 0.0444, wR ref (F 2 ) = 0.1234, T = 100 K.
Open Access
Crystal structure of diethylammonium 1,3-dimethyl-2,4,6-trioxohexahydropyrimidin-5-ide, C₁₀H₁₉N₃O₃

June 30, 2016

Assem Barakat, Hazem A. Ghabbour, Abdullah Mohammed Al-Majid, Mohammad Shahidul Islam, Mohammed Rafi Shaik

Page range: 1063-1064

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C 10 H 19 N 3 O 3 , monoclinic, P 2 1 / n , a = 4.4714(2) Å, b = 17.8690(7) Å, c = 14.6323(6) Å, β = 95.272(1)°, V = 1164.17(8) Å 3 , Z = 4, R gt (F) = 0.0518, wR ref (F 2 ) = 0.1370, T = 100 K.
Open Access
Crystal structure of 1,1-dimethyl-3-(2-phenylethyl)urea, C₁₁H₁₆N₂O

May 21, 2016

Gamal A. El-Hiti, Keith Smith, Mohammed B. Alshammari, Mohammad Hayal Alotaibi, Benson M. Kariuki

Page range: 1065-1066

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C 11 H 16 N 2 O, orthorhombic, Pbca (no. 61), a = 10.7388(6) Å, b = 9.8449(5) Å, c = 21.1259(14) Å, V = 2233.5(2) Å 3 , Z = 8, R gt (F) = 0.0582, wR ref (F 2 ) = 0.1795, T = 293 K.
Open Access
Crystal structure of 2-(4-methoxyphenyl)-1,3-thiazolo[4,5-b]pyridine, C₁₃H₁₀N₂OS

June 15, 2016

Gamal A. El-Hiti, Keith Smith, Amany S. Hegazy, Saud A. Alanazi, Benson M. Kariuki

Page range: 1067-1068

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C 13 H 10 N 2 OS, monoclinic, P 2 1 / c (no 14), a = 14.182(3) Å, b = 5.9674(6) Å, c = 26.683(4) Å, β = 101.162(17)°, V = 2215.4(6) Å 3 , Z = 8, R gt (F) = 0.0634, wR ref (F 2 ) = 0.1514, T = 150 K.
Open Access
Crystal structure of 3-tert-butyl-7-azadioxindole, C₁₁H₁₄N₂O₂

June 22, 2016

Gamal A. El-Hiti, Keith Smith, Amany S. Hegazy, Ali M. Masmali, Benson M. Kariuki

Page range: 1069-1070

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C 11 H 14 N 2 O 2 , orthorhombic, P 2 1 2 1 2 1 (no. 19), a = 7.3227(3) Å, b = 10.9955(4) Å, c = 26.3709(9) Å, V = 2123.30(14) Å 3 , Z = 8, R gt (F) = 0.0372, wR ref (F 2 ) = 0.0907, T = 150 K.
Open Access
Crystal structure of 1-ferrocenyl-6-bromopyrene, C₂₆H₁₇BrFe

June 22, 2016

Zhang Ran, Ni Zhong-Hai

Page range: 1071-1072

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C 26 H 17 BrFe, monoclinic, C 2/ c (no. 15), a = 30.486(10) Å, b = 7.497(3) Å, c = 18.669(6) Å, β = 120.184(5)°, V = 3688(2) Å 3 , Z = 8, R gt (F) = 0.0407, wR ref (F 2 ) = 0.1015, T = 296(2) K.
Open Access
Crystal structure of 3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide, C₁₆H₁₃BrFN₃S

June 11, 2016

Hazem A. Ghabbour, Bakr F. Abdel-Wahab, Mohammed Baashen, Majid Mohammad Asmari, Gamal A. El-Hiti

Page range: 1073-1074

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C 16 H 13 BrFN 3 S, monoclinic, P 2 1 / c , a = 14.6734(6) Å, b = 11.1226(5) Å, c = 9.4184(4) Å, β = 102.524(2)°, V = 1500.57(11) Å 3 , Z = 4, R gt (F) = 0.0473, wR ref (F 2 ) = 0.1182, T = 100 K.
Open Access
Crystal structure of 2-amino-4-(3,5-ditrifluoromethylphenyl)-3-cyano-7,7-dimethyl-5-oxo-4H-5,6,7,8-tetrahydrobenzo[b]pyran, C₂₀H₁₆F₆N₂O₂

June 1, 2016

Zhi-Jun Liu, Yan li, Shi-Qing Lu, Yan-Li Xu

Page range: 1075-1076

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C 6 H 25 Br 3 N 2 O 3 P 2 , triclinic, P 1̅ (No. 2), a = 8.6192(6) Å, b = 10.0012(11) Å, c = 12.8047(8) Å, α = 110.699(8)°, β = 95.859(6)°, γ = 99.141(7)°, V = 1004.36(15) Å 3 , Z = 2, R gt (F) = 0.0777, wR ref (F 2 ) = 0.1918, T = 293(2) K.
Open Access
The crystal structure of 2-amino-4-(4-nitrophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, C₁₆H₁₃N₃O₄

June 30, 2016

Yunchun Luo, Wen Yi, Yuzhou Yao, Ni Zhu, Pengfei Qin

Page range: 1077-1078

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C 16 H 13 N 3 O 4 , monoclinic, C 2/ c (No. 15), a = 13.8536(12) Å, b = 11.0922(7) Å, c = 20.432(2) Å, β = 108.491(10)°, V = 2977.6(4) Å 3 , Z = 8, R gt (F) = 0.0533, wR ref (F 2 ) = 0.1452, T = 293(2) K.
Open Access
Crystal structure of 2-amino-4-(2, 4-dichlorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, C₁₆H₁₂Cl₂N₂O₂

June 22, 2016

Lian-Man He, Chuan-Yu Gao

Page range: 1079-1080

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C 16 H 12 Cl 2 N 2 O 2 , monoclinic, C 2/ c (no. 15), a = 24.944(3) Å, b = 8.9007(8) Å, c = 16.3770(18) Å, β = 119.710(10)°, V = 3158.0(6) Å 3 , Z = 8, R gt (F) = 0.0527, wR ref (F 2 ) = 0.1602, T = 293(2) K.
Open Access
Crystal structure of bis(μ₂-chlorido)-bis(di-p-tolylhydroxyphosphine-κP)-bis(di-p-tolylphosphite-κP)dipalladium(II), C₅₆H₅₈Cl₂O₄P₄Pd₂

June 25, 2016

Dumisani V. Kama, Alice Brink, Hendrik G. Visser

Page range: 1081-1083

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C 56 H 58 Cl 2 O 4 P 4 Pd 2 , monoclinic, P 2 1 / c (no. 14), a = 12.736(2) Å, b = 18.187(2) Å, c = 12.335(2) Å, β = 109.053(4)°, V = 2700.63 Å 3 , Z = 2, R gt ( F ) = 0.034, wR ref ( F 2 ) = 0.0955, T = 100 K .
Open Access
Crystal structure of diaqua-bis(2-methyl-1H-imidazole-4,5-dicarboxylato-κ²-O,N)cadmium(II) tetrahydrate, C₁₂H₂₂CdN₄O₁₄

June 25, 2016

Zhi-Qiang Xiong, Xiu-Ying Song, Xu-Liang Nie

Page range: 1085-1086

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C 12 H 22 CdN 4 O 14 , triclinic, P 1̅ (no. 2), a = 7.188(2) Å, b = 8.895(3) Å, c = 9.771(3) Å, α = 63.148(3)°, β = 76.750(3)°, γ = 66.225(3)°, V = 509.2(3) Å 3 , Z = 1, R gt (F) = 0.0253, wR ref (F 2 ) = 0.0676, T = 296(2) K.
Open Access
Crystal structure of aqua-(5-nitrosalicylato-κ²O,O′)-(1,10-phenanthroline-κ²N,N′)copper(II), C₁₉H₁₃CuN₃O₆

July 14, 2016

Zhiwei Tang, Guixiang Xie, Yan Dong, Decai Wen

Page range: 1087-1088

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C 19 H 13 CuN 3 O 6 , monoclinic, P 2 1 / c , a = 7.208(3) Å, b = 21.720(8) Å, c = 11.098(5) Å, β = 99.085(17)°, V = 1715.8(12) Å 3 , Z = 4, R gt ( F ) = 0.0428, wR ref ( F 2 ) = 0.1044, T = 293 K.
Open Access
Crystal structure of bis(4-(2-phenylpropan-2-yl)phenyl)amine, C₃₀H₃₁N

June 11, 2016

Limin Wang, Shengpei Wang, Shenggao Liu

Page range: 1089-1090

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C 30 H 31 N, triclinic, P 1̅ (no. 2), a = 8.9828(11) Å, b = 10.1648(12) Å, c = 13.2961(15) Å, α = 81.273(2)°, β = 72.201(2)°, γ = 82.271(2)°, V = 1137.5(2) Å 3 , Z = 2, R gt (F) = 0.0581, wR ref (F 2 ) = 0.1545, T = 140(2) K.
Open Access
Crystal structure of 2-amino-4-(3,5-difluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, C₁₈H₁₆F₂N₂O₂

July 6, 2016

He Lou

Page range: 1091-1092

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C 18 H 16 F 2 N 2 O 2 , monoclinic, P 2 1 / c (no. 14), a = 11.619(3) Å, b = 9.481(2) Å, c = 14.555(3) Å, β = 98.799(4)°, V = 1584.6(6) Å 3 , Z = 4, R gt ( F ) = 0.0404, wR ref ( F 2 ) = 0.1139, T = 293(2) K.
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Crystal structure of 2-amino-4-(3,4,5-trifluorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, C₁₆H₁₁F₃N₂O₂

June 30, 2016

Xi-Ping Zhang, Fei-Jiang Yu, Xiang-Ming He, De-Hong Zou

Page range: 1093-1094

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C 16 H 11 F 3 N 2 O 2 , triclinic, P 1̅ (No. 2), a = 8.3288(5) Å, b = 8.6385(8) Å, c = 11.6004(8) Å, α = 111.488(7)°, β = 94.705(6)°, γ = 99.107(6)°, V = 757.87(10) Å 3 , Z = 2, R gt (F) = 0.0435, wR ref (F 2 ) = 0.0954, T = 293(2) K.
Open Access
Crystal structure of an isomeric bis[(η⁵:η¹-6,6-di-p-tolylpentafulvene)(η⁵-pentamethylcyclopentadienyl)titanium(III)]-μ²,η¹:η¹-dinitrogen complex, C₆₀H₆₆N₂Ti₂

July 6, 2016

Tim Oswald, Annika Frey, Marc Schmidtmann, Rüdiger Beckhaus

Page range: 1095-1097

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C 60 H 66 N 2 Ti 2 , triclinic, P 1̅ (no. 2), a = 8.8070(3) Å, b = 11.9544(5) Å, c = 12.3447(5) Å, α = 66.7623(13)°, β = 89.0505(13)°, γ = 80.9952(13)°, V = 1178.06(8) Å 3 , Z = 1, R gt (F) = 0.0426, wR ref (F 2 ) = 0.1046, T = 100(2) K.
Open Access
Crystal structure of 3,4-dinitropyrazole, C₃H₂N₄O₄

July 7, 2016

Chen Lizhen, Song Liang, Cao Duanlin, Wang Jianlong

Page range: 1099-1100

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C 3 H 2 N 4 O 4 , monoclinic, P 2 1 / c (No. 14), a = 9.7013(13) Å, b = 12.0797(10) Å, c = 9.7587(7) Å, β = 93.962(11)°, V = 1140.88(19) Å 3 , Z = 8, R gt (F) = 0.0408, wR ref (F 2 ) = 0.1001, T = 105.3 K.
Open Access
Crystal structure of (4-vinylpyridine-κN)triphenyl tin(IV) chloride, C₂₅H₂₂ClNSn

August 10, 2016

Hans Reuter, Tobias Gieschen

Page range: 1101-1104

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C 25 H 22 ClNSn, monoclinic, P 2 1 / c (no. 14), a = 17.8179(8) Å, b = 15.6453(6) Å, c = 17.4603(7) Å, β = 116.588(2)°, V = 4352.6(3) Å 3 , Z = 8, R gt ( F ) = 0.0297, wR ref ( F 2 ) = 0.0681, T = 100 K.
Open Access
Crystal structure of tert-butyl 2-phenylethylcarbamate, C₁₃H₁₉NO₂

July 6, 2016

Gamal A. El-Hiti, Keith Smith, Mohammed B. Alshammari, Mansour D. Ajarim, Benson M. Kariuki

Page range: 1105-1107

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C 13 H 19 NO 2 , monoclinic, P 2 1 / n (no. 14), a = 5.2692(3) Å, b = 13.8663(9) Å, c = 17.8020(13) Å, β = 93.323(6)°, V = 1298.50(15), Z = 4, R gt ( F ) = 0.0590, wR ref ( F 2 ) = 0.1932, T = 293 K.
Open Access
Crystal structure of (Z)-4-((E)-(4-chlorobenzyli-dene)hydrazono)-1-p-tolylpyrrolidine-3-carbonitrile, C₁₉H₁₇ClN₄

August 24, 2016

Gamal A. El-Hiti, Bakr F. Abdel-Wahab, Mohammed Baashen, Amany S. Hegazy, Benson M. Kariuki

Page range: 1109-1110

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C 19 H 17 ClN 4 , triclinic, P 1̅ (no. 2), a = 6.9042(5) Å, b = 7.1990(5) Å, c = 18.2633(13) Å, α = 86.727(6)°, β = 79.214(6)°, γ = 69.876(7)°, V = 837.25(11) Å 3 , Z = 2, R gt ( F ) = 0.0553, wR ref ( F 2 ) = 0.1406, T = 296(2) K.
Open Access
Crystal structure of bis(biphenyl-2,2′-dicarboxylato-κ²O:O′)-bis(1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydroquinoline-3-carboxylato-κ²O,O′)dizinc(II)2.5 hydrate, C₆₂H₅₇N₆Zn₂O_16.5F₂

July 18, 2016

Yong-Jun Hu, Ling Zhu, Zhe An, Tian Zhou

Page range: 1111-1113

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C 62 H 57 N 6 Zn 2 O 16.5 F 2 , triclinic, P 1̅ (no. 2), a = 10.026(4) Å, b = 12.064(4) Å, c = 13.385(5) Å, α = 112.473(3)°, β = 105.835(4)°, γ = 91.309(4)°, V = 1424.4(9) Å 3 , Z = 1, R gt ( F ) = 0.0266, wR ref ( F 2 ) = 0.0707, T = 100(2) K.
Open Access
Crystal structure of dichloridobis{μ₂-2,2′-((1E,1′E)-(ethane-1,2-diylbis(azanylylidene))bis(methanylylidene))bis(4-chlorophenolato)-κ⁵O,N,N′,O′:O′}diiron(III), C₃₂H₂₄Cl₆Fe₂N₄O₄

June 29, 2016

Mauricio Fuentealba, Deborah González, Vania Artigas

Page range: 1115-1116

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C 32 H 24 Cl 6 Fe 2 N 4 O 4 , triclinic, P 1̅ (No. 2), a = 7.3325(10) Å, b = 9.1317(14) Å, c = 13.161(2) Å, α = 105.927(4)°, β = 95.407(4)°, γ = 96.752(4)°, V = 834.1(2) Å 3 , Z = 1, R gt ( F ) = 0.0382, wR ref ( F 2 ) = 0.0897, T = 296.15 K.
Open Access
Crystal structure of 4-((4,4-dimethyl-2, 6-dioxocyclohexylidine)methylamino)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide, C₂₀H₂₃N₃O₅S

July 18, 2016

Mostafa M. Ghorab, Mansour S. Alsaid, Hazem A. Ghabbour, Abdullah A. Al-Mishari, Obaid S. AlRuqi

Page range: 1117-1119

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C 20 H 23 N 3 O 5 S, monoclinic, P 2 1 / c (no. 14), a = 6.7503(2) Å, b = 14.0026(7) Å, c = 21.954(1) Å, β = 96.892(3)°, V = 2060.14(15) Å 3 , Z = 4, R gt ( F ) = 0.0545, wR ref ( F 2 ) = 0.1192, T = 100 K.
Open Access
Crystal structure of poly-[aqua-μ₂-aqua-μ₂-(4,4′-oxybis(benzoato)-κ⁴O,O′:O′′,O′′′)cadmium(II)], C₁₄H₁₂O₇Cd

August 10, 2016

Bao Guang-Ming, Xiao Wei, Sun Ting-Ting, Hu Chun-Yan, Wang Yi-Hua, Yuan Hou-Qun

Page range: 1121-1122

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C 14 H 12 O 7 Cd, orthorhombic, Ima 2 (no. 46), a = 30.715(3) Å, b = 7.8833(8) Å, c = 5.8202(6) Å, V = 1409.3(2) Å 3 , Z = 4, R gt ( F ) = 0.0159, wR ref ( F 2 ) = 0.0400, T = 296(2) K.
Open Access
Crystal structure of aqua(μ₂-biphenyl-2,2′-dicarboxylato-κ³O,O′:O′′)-(μ₂-1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydroquinoline-3-carboxylato-κ²O,O′)cadmium(II) 1.5 hydrate, C₆₂H₆₀N₆Cd₂O₁₉F₂

August 10, 2016

Ling Zhu, Yong-Jun Hu, Zhe An, Tian Zhou

Page range: 1123-1125

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C 62 H 60 N 6 Cd 2 O 19 F 2 , triclinic, P 1̅ (no. 2), a = 9.749(4)Å, b = 12.884(5) Å, c = 13.869(5) Å, α = 70.103(4)°, β = 80.201(4)°, γ = 68.648(4)°, V = 1523.3(10) Å 3 , Z = 1, R gt ( F ) = 0.0549, wR ref ( F 2 ) = 0.1716, T = 100(2) K.
Open Access
Crystal structure of dimethanolo-bis[μ-(2-(2-(5-(pyridin-2-yl)-1H-1,2,4-triazol-3-yl)phenoxy)benzoato)-κ⁵O,O′,N:N′,N′′]dicopper(II) — methanol (1/2), C₄₆H₄₈Cu₂N₈O₁₂

August 10, 2016

Guo Qiang Li, Jia Hong He, Cai Yun Hui, Qiang Xu

Page range: 1127-1129

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C 46 H 32 Cu 2 N 8 O 12 , monoclinic, P 2 1 / c , a = 9.5638(9)Å, b = 20.2142(19) Å, c = 12.0825(11) Å, β = 94.696(1)°, V = 2328.0(4) Å 3 , Z = 2, R gt ( F ) = 0.0273, wR ref ( F 2 ) = 0.0711, T = 100 K.
Open Access
Crystal structure of poly-[tetraaqua-bis(μ₄-2,5-dibenzoyl-1,4-benzenedicarboxylato-κ⁴O¹:O²:O³:O⁴)-μ₂-2,5-dibenzoyl-1,4-benzenedicarboxylato-k⁴O⁵,O⁶: O⁵′,O⁶′-didysprosium(III)] tetrahydrate C₃₃H₂₆O₁₃Dy

August 6, 2016

Xiao-fei Zhu, Yu Yang, Xiao-yan Xie, Ya-feng Li

Page range: 1131-1133

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C 33 H 26 O 13 Dy, triclinic, P 1̅ (no. 2), a = 10.5417(4) Å, b = 12.0923(6) Å, c = 12.4320(4) Å, α = 82.373(3)°, β = 81.126(3)°, γ = 89.446(3)°, V = 1551.83(11) Å 3 , Z = 2, R gt ( F ) = 0.0357, wR ref ( F 2 ) = 0.0820, T = 293 K.
Open Access
Crystal structure of hexaaqua-bis(3-(3-pyridin-4-yl-[1,2,4]oxadiazol-5-yl) propionato-κ³O,O′:O′)-bis(3-(3-pyridin-4-yl-[1,2,4]oxadiazol-5-yl)propionato-κO)-bis(3-(3-pyridin-4-yl-[1,2,4]oxadiazol-5-yl)propionato-κ²O,O′)dineodymium(III) octahydrate, C₆₀H₇₆N₁₈O₃₂Nd₂

August 18, 2016

Fang Zhang, Fang Huang, Zhaoqun Zhang, Yanhua Lu, Qifan Chen, Fei Liu

Page range: 1135-1137

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C 60 H 76 N 18 O 32 Nd 2 , monoclinic, P 2 1 / c (no. 14), a = 10.609(5) Å, b = 31.215(5) Å, c = 12.407(4) Å, β = 116.54(3)°, V = 3676(2) Å 3 , Z = 2, R gt ( F ) = 0.0450, wR ref ( F 2 ) = 0.0910, T = 293(2) K.
Open Access
Crystal structure of poly-[triaqua-(μ₃-3,4,5,6-tetrafluoro-1,2-phthalato-κ⁴O:O′:O′′,O′′′) (2,3,4,5-tetrafluoro-benzoato-κ²O,O′) praseodymium(III)], C₁₅H₇F₈O₉Pr

September 17, 2016

Xun Feng, Rong Fang Li, Yang Wang, Pan Hao Tian

Page range: 1139-1141

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C 15 H 7 F 8 O 9 Pr, monoclinic, P 2 1 / n (no. 14), a = 6.2167(3) Å, b = 9.7769(5) Å, c = 29.6562(15) Å, β = 93.2916(8)°, V = 1799.53 Å 3 , Z = 4, R gt ( F ) = 0.0317, wR ref ( F 2 ) = 0.0729, T = 293(2) K.
Open Access
The crystal structure of dichlorido (1,3-dimesityl-1H-3λ⁴-imidazol-2-yl)(isoquinoline-κN)palladium(IV) – ethylacetate (1/1), C₃₄H₃₉Cl₂N₃O₂Pd

July 14, 2016

Feng Liu, Guo-Xing Li

Page range: 1143-1144

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C 34 H 39 Cl 2 N 3 O 2 Pd, triclinic, P 1̅, a = 10.3988(8) Å, b = 12.1983(10) Å, c = 12.9114(10) Å, α = 85.034(1)°, β = 89.123(1)°, γ = 79.519(1)°, V = 1604.4(2) Å 3 , Z = 2, R gt ( F ) = 0.0472, wR ref ( F 2 ) = 0.1285, T = 100(2) K.
Open Access
Crystal structure of dichlorido(1,3-bis(2,6-dimethyl-phenyl)-1H-3λ⁴-imidazol-2-yl)(isoquinolinyl)palladium(IV), C₂₈H₂₇Cl₂N₃Pd

August 15, 2016

Feng Liu, Guo-Xing Li

Page range: 1145-1147

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C 28 H 27 Cl 2 N 3 Pd, monoclinic (no. 15), C 2/ c , a = 24.7394(17) Å, b = 15.9451(11) Å, c = 27.4301(19) Å, β = 107.8650°, V = 10293.7(12) Å 3 , Z = 16, R gt ( F ) = 0.0249, wR ref ( F 2 ) = 0.1168, T = 100(2) K.
Open Access
Crystal structure of 5-(4-(1H-tetrazol-5-yl)phenyl)-1H-imidazol-3-ium 7-carboxy-1,3-dioxo-1H,3H-benzo[de]isochromene-6-carboxylate monohydrate 4,5-anhydride, C₂₄H₁₆N₆O₈

August 10, 2016

Liang-Quan Sheng, Hua-Jie Xu

Page range: 1149-1151

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C 6 H 25 Br 3 N 2 O 3 P 2 , monoclinic, P 2 1 / c (no. 14), a = 8.9705(10) Å, b = 25.494(3) Å, c = 10.2372(12) Å, β = 112.888(2)°, V = 2156.8(49) Å 3 , Z = 4, R gt ( F ) = 0.0467, wR ref ( F 2 ) = 0.1296, T = 296(2) K.
Open Access
Crystal structure of poly-[diaqua-bis(μ₂-2-((1H-1,2,4-triazol-5-yl)thio)acetato-κ²N:O) cadmium(II)], C₈H₈CdN₆O₆S₂

August 18, 2016

Min-Dong Chen, Xing Zhang, Bo Xiao, Feng-Hua Chen

Page range: 1153-1154

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C 8 H 8 CdN 6 O 6 S 2 , monoclinic, P 2 1 / c (no. 14), a = 7.4175(11) Å, b = 13.786(2) Å, c = 7.4934(11) Å, β = 93.835(2)°, V = 3972.0(12) Å 3 , Z = 2, R gt ( F ) = 0.0193, wR ref ( F 2 ) = 0.0581, T = 296(2) K.
Open Access
Crystal Structure of (E)-3-(4-methoxyphenyl)-1-(2,3,4-tris(benzyloxy)-6-hydroxyphenyl)prop-2-en-1-one, C₃₇H₃₂O₆

August 6, 2016

Chen-Miao Kuo, Tania N. Hill, Barend C. B. Bezuidenhoudt

Page range: 1155-1157

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C 37 H 32 O 6 , monoclinic, P 2 1 / c (No. 14), a = 5.5354(7) Å, b = 16.983(2) Å, c = 31.211(4) Å, β = 91.535(8)°, V = 2932.9(7) Å 3 , Z = 4, R gt ( F ) = 0.0584, wR ref ( F 2 ) = 0.1738, T = 100 K.
Open Access
Structure and photochromism of 1-(1,2-dimethylindol-3-yl)-2-[2-methyl-5-(3-fluorophenyl)-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopent-1-ene, C₂₆H₁₈F₇NS

August 11, 2016

Chunhong Zheng, Erting Feng, Congbin Fan, Shouzhi Pu

Page range: 1159-1161

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C 26 H 18 F 7 NS, triclinic, P 1̅, a = 8.492(18) Å, b = 11.23(2) Å, c = 14.75(3) Å, α = 68.93(2)°, β = 74.90(2)°, γ = 68.35(2)°, V = 1206(4) Å 3 , Z = 2, R gt ( F ) = 0.0511, wR ref ( F 2 ) = 0.1643, T = 296(2) K.
Open Access
Crystal structure of two-dimensional coordination polymer poly-[μ₂-azido-aqua-(μ₂-pyrazine-2-carboxylato-κ³O,N:N′)nickel(II)], C₅H₅N₅O₃Ni

August 11, 2016

Yu Youzhu, Guo Yuhua, Yang Liguo, Niu Yongsheng

Page range: 1163-1164

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C 5 H 5 N 5 O 3 Ni, monoclinic, C 2/ c (no. 15), a = 8.5804(17) Å, b = 13.790(3) Å, c = 13.969(3) Å, β = 104.37(3)°, V =1601.2(6)Å 3 , Z = 8, R gt ( F ) = 0.0203, wR ref ( F 2 ) = 0.0550, T = 293 K.
Open Access
Crystal structure of 2-amino-5-oxo-4-(3,5-bis(trifluoromethyl)phenyl)-4H,5H-pyrano [3,2-c]chromene-3-carbonitrile, C₂₁H₁₀F₆N₂O₃

August 15, 2016

Yunhui Zhai, Jing Li

Page range: 1165-1166

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C 21 H 10 F 6 N 2 O 3 , monoclinic, P 2 1 / c (no. 14), a = 11.8113(7) Å, b = 7.8929(3) Å, c = 21.4129(18) Å, β = 105.012(7)°, V = 1928.1(2) Å 3 , Z = 4, R gt ( F ) = 0.0632, wR ref ( F 2 ) = 0.1347, T = 293(2) K.
Open Access
Crystal structure of 4-(5-((2-methylbenzyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine, C₂₁H₁₈N₄S

June 30, 2016

Guo-Xiang Sun, Zhao-Hui Sun, Ming-Yan Yang, Hong-Ke Wu

Page range: 1167-1168

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C 21 H 18 N 4 S, monoclinic, P 2 1 / c (no. 14), a = 18.264(2) Å, b = 11.6302(14) Å, c = 8.9289(10) Å, β = 101.683(7)°, V = 1857.3(4) Å 3 , Z = 4, R gt (F) = 0.0435, w R ref ( F 2 ) = 0.1122, T = 296(2) K.
Open Access
Crystal structure of 5-(2-chloro-5-nitrophenyl)-3-(4-chlorophenyl)-N-ethyl-4,5-dihydro-1H-pyrazole-1-carbothioamide, C₁₈H₁₆Cl₂N₄O₂S

August 15, 2016

Gamal A. El-Hiti, Bakr F. Abdel-Wahab, Mesfer Alamri, Mohamed A. Al-Omar, Hazem A. Ghabbour

Page range: 1169-1170

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C 18 H 16 Cl 2 N 4 O 2 S, monoclinic, P 2 1 / c (no. 14), a = 9.1950(5) Å, b = 23.9750(13) Å, c = 9.5514(5) Å, β = 111.136(2)°, V = 1963.96(18) Å 3 , Z = 4, R gt ( F ) = 0.0516, wR ref ( F 2 ) = 0.139, T = 296 K.
Open Access
Crystal structure of 4-(benzofuran-2-yl)-2-(3-(4-fluorophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl)thiazole, C₂₈H₂₀FN₃OS

August 11, 2016

Gamal A. El-Hiti, Bakr F. Abdel-Wahab, Amany S. Hegazy, Mansour D. Ajarim, Benson M. Kariuki

Page range: 1171-1173

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C 28 H 20 FN 3 OS, triclinic, P 1̅ (no. 2), a = 9.5719(5) Å, b = 10.7499(6) Å, c = 10.9238(5) Å, α = 95.470(4)°, β = 102.133(4)°, γ = 97.962(4)°, V = 1079.30(10) Å 3 , R gt ( F ) = 0.0482, wR ref ( F 2 ) = 0.1143, T = 150(2) K.
Open Access
Crystal structure of bis(dicyanamido-κ¹N)-tetrakis[1-benzyl-1H-1,2,4-triazole-κ¹N]cobalt(II), CoC₄₀H₃₆N₁₈

September 17, 2016

Xia Zhu, Yong-feng Wang

Page range: 1175-1176

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CoC 40 H 36 N 18 , monoclinic, P 2 1 / c (no. 14), a = 9.7410(15) Å, b = 15.511(2) Å, c = 14.162(2) Å, β = 110.00(3)°, V = 2010.7(5) Å 3 , Z = 2, R gt ( F ) = 0.0395, wR ref ( F 2 ) = 0.0869, T = 223(2) K.
Open Access
Crystal structure of 1-benzyl-6-hydroxy-1,4,5,6-tetrahydropyridine-3-carbonitrile, C₁₃H₁₄N₂O

August 22, 2016

Qi-Di Zhong, Hao Zhu, Shao-Fei Bai, Hong Yan

Page range: 1177-1178

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C 13 H 14 N 2 O, monoclinic, P 2 1 / c (no. 14), a = 9.933(2) Å, b = 22.120(6) Å, c = 10.487(3) Å, β = 90.160(7)°, V = 2304.2(10) Å 3 , Z = 8, R gt ( F ) = 0.0452, wR ref ( F 2 ) = 0.0808, T = 293 K.
Open Access
Crystal structure of 2-amino-7-methyl-4-(3,4-difluoro-phenyl)-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile, C₁₆H₁₀F₂N₂O₃

August 22, 2016

Dongjing Zheng, Yige Yang, Jing Li

Page range: 1179-1180

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C 16 H 10 F 2 N 2 O 3 , monoclinic, P 2 1 / c (no. 14), a = 9.4647(7) Å, b = 11.8726(7) Å, c = 12.5732(8) Å, β = 92.262(4)°, V = 1411.76(16) Å 3 , Z = 4, R gt ( F ) = 0.0459, wR ref ( F 2 ) = 0.1285, T = 293 K.
Open Access
The crystal structure of 4-[(benzo[1,3]dioxol-5-ylmethylene)-amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one, C₁₉H₁₇N₃O₃

August 24, 2016

Faisal M. S. Aqlan, Muhammad Nadeem Arshad, Abdullah M. Asiri, Khalid A. Khan, Mohie E. M. Zayed

Page range: 1181-1183

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C 19 H 17 N 3 O 3 , monoclinic, P 2 1 / a (no. 14), a = 7.1173(4) Å, b = 25.051(2) Å, c = 9.3822(8) Å, β = 100.484(6)°, V = 1644.9(2) Å 3 , Z = 4, R gt ( F ) = 0.0571, wR ref ( F 2 ) = 0.1457, T = 296 K.
Open Access
Crystal structure of 1,4-dihydro-1-phenylchromeno[4,3-c]pyrazole, C₁₆H₁₂N₂O

August 18, 2016

Abd El-Galil E. Amr, Naglaa A. Abdel Hafez, Korany A. Ali, Mohamed A. Al-Omar, Hazem A. Ghabbour

Page range: 1185-1187

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C 16 H 12 N 2 O, orthorhombic, P 2 1 2 1 2 1 (no. 19), a = 5.4475(3) Å, b = 12.2779(7) Å, c = 18.0975(11) Å, V = 1210.43(12) Å 3 , Z = 4, R gt ( F ) = 0.0326, wR ref ( F 2 ) = 0.0855, T = 100 K.
Open Access
Crystal structure of N-(5-((3,5-dimethylisoxazol-4-yl)sulfonyl)quinolin-8-yl)benzamide, C₂₁H₁₇N₃O₄S

August 18, 2016

Wen-Bo Yu, Jun Xu, Peng-fei Zhang

Page range: 1189-1191

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C 21 H 17 N 3 O 4 S, triclinic, P 1̅ (no. 2), a = 10.0424(5) Å, b = 10.4142(4) Å, c = 18.7420(10) Å, α = 91.746(4)°, β = 90.169(4)°, γ = 100.878(4), V = 1923.92(16) Å 3 , Z = 4, R gt ( F ) = 0.0487, wR ref ( F 2 ) = 0.1036, T = 293(2) K.
Open Access
Crystal structure of 3-amino-9-methoxy-1-phenyl-1H-benzo[f]chromene-2-carbonitrile, C₂₁H₁₆N₂O₂

August 18, 2016

Ahmed M. El-Agrody, Abd El-Galil E. Amr, Nermien M. Sabry, Mohamed A. Al-Omar, Hazem A. Ghabbour

Page range: 1193-1195

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C 21 H 16 N 2 O 2 , monoclinic, P 2 1 / n (no. 14), a = 13.4768(7) Å, b = 6.9225(3) Å, c = 18.2840(8) Å, β = 107.601(2)°, V = 1625.92(13) Å 3 , Z = 4, R gt ( F ) = 0.0593, wR ref ( F 2 ) = 0.1529, T = 100 K.
Open Access
Crystal structure of 1,2-bis(4-methoxyphenyl)-2-((3-(trifluoromethyl)phenyl)amino)ethan-1-one, C₂₃H₂₀F₃NO₃

September 9, 2016

Abd El-Galil E. Amr, Hanaa M. Hosni, Hazem A. Ghabbour

Page range: 1197-1199

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C 23 H 20 F 3 NO 3 , monoclinic, C 2/ c (no. 15), a = 48.3041(18) Å, b = 6.0540(2) Å, c = 28.5445(11) Å, β = 105.519(2)°, V = 8043.0(5) Å 3 , Z = 16, R gt ( F ) = 0.056, wR ref ( F 2 ) = 0.140, T = 293(2) K.
Open Access
Crystal structure of 2-amino-4-(2,4-dinitrophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile – ethanol (1:1), C₂₁H₁₆N₄O₈

September 13, 2016

Wei-Hua Zhou

Page range: 1201-1202

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C 21 H 16 N 4 O 8 , triclinic, P 1̅ (no. 2), a = 8.3222(6) Å, b = 10.8926(7) Å, c = 11.6941(8) Å, α = 78.182(6)°, β = 86.960(6)°, γ = 76.646(6)°, V = 1009.53(12) Å 3 , Z = 2, R gt ( F ) = 0.0556, wR ref ( F 2 ) = 0.1850, T = 293 K.
Open Access
Crystal structure of catena-poly-[(1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-ium-1-yl)-1,4-dihydroquinoline-3-carboxylate-κ²O,O′)-(μ₂-4,4′-sulfonyldibenzoato-κ⁴O,O′:O′′,O′′′)zinc(II)] hemihydrate, C₃₁H₂₇ZnFN₃O_9.5S

September 17, 2016

Zhuo-Wen Fan, Liang-Liang Wang, Kuo Cui, Ying Meng, Ji-Zhi Liu

Page range: 1203-1205

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C 31 H 27 ZnFN 3 O 9.5 S, triclinic, P 1̅ (no. 2), a = 10.6434(4) Å, b = 12.6191(4) Å, c = 12.8532(5) Å, α = 93.998(3)°, β = 109.121(3)°, γ = 112.773(3)°, V = 1465.16(9) Å 3 , Z = 2, R gt ( F ) = 0.0354, wR ref ( F 2 ) = 0.1012, T = 293 K.
Open Access
Crystal structure of 2-(2-bromophenyl)-5-methyl-1,3-dioxane-5-carboxylic acid, C₁₂H₁₃BrO₄

August 10, 2016

Guo-Kai Jia, Lin Yuan, Min Zhang, Xian-You Yuan, Fang Liu

Page range: 1207-1208

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C 12 H 14 BrO 4 , monoclinic, P 2 1 / n , a = 9.599(2) Å, b = 14.399(3) Å, c = 9.2361(19) Å, β = 100.182(2)°, V = 1256.5(5) Å 3 , Z = 4, R gt ( F ) = 0.0285, wR ref ( F 2 ) = 0.0779, T = 296(2) K.
Open Access
Crystal structure of 2-(2-bromophenyl)-5-ethyl-1,3-dioxane-5-carboxylic acid, C₁₃H₁₅BrO₄

September 17, 2016

Lin Yuan, Xian-You Yuan, Zhong-Yan Li, Min Zhang

Page range: 1209-1210

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C 13 H 15 BrO 4 , orthorhombic, Pbca (no. 61), a = 15.894(3) Å, b = 7.6064(16) Å, c = 21.571(4) Å, V = 2607.8(9) Å 3 , Z = 8, R gt ( F ) = 0.0268, wR ref ( F 2 ) = 0.0702, T = 296(2) K.
Open Access
Crystal structure of 4-(4-((3-bromophenyl)amino)-6-(tert-butyl)-3-(2-hydroxypropan-2-yl)cinnolin-8-yl)-2-methylbut-3-yn-2-ol, C₂₆H₃₀BrN₃O₂

September 17, 2016

Yue-Hua Yuan, Qiang-Feng Yin, Mao-Zhong Tian, Feng Feng

Page range: 1211-1213

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C 26 H 30 BrN 3 O 2 , triclinic, P 1̅ (no. 2), a = 12.257(3) Å, b = 12.451(3) Å, c = 17.325(3) Å, α = 92.05(3)°, β = 107.04(3)°, γ = 93.96(3)°, V = 2517.5(10) Å 3 , Z = 4, R gt ( F ) = 0.0722, wR ref ( F 2 ) = 0.1929, T = 173(2) K.
Open Access
Crystal structure poly-(μ₂-1-(4-(1H-imidazol-1-yl)benzyl)-1H-1,2,4-triazolyl-κ²NN¹:N²N)-(μ₃-2,2′-(1,2-phenylene)diacetato-κ⁵-O¹,O²:O²:O³,O⁴)cadmium(II), C₂₂H₁₉CdN₅O₄

September 17, 2016

Ling-Yun Xin, Xiao-Ling Li, Guang-Zhen Liu

Page range: 1215-1217

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C 22 H 19 CdN 5 O 4 , monoclinic, P 2 1 / c , a = 11.7546(16) Å, b = 19.769(3) Å, c = 9.5012(13) Å, β = 106.252(2)°, V = 2119.6(5) Å 3 , Z = 4, R gt ( F ) = 0.0348, wR ref ( F 2 ) = 0.0814, T = 296(2) K.
Open Access
Crystal structure of bis(1-ethyl-6-fluoro-4-oxido-7-(piperazin-1-ium-1-yl)-1,8-naphthyridin-1-ium-3-carboxylate-κ²O,O′)copper(II) benzene-1, 4-dicarboxylate dihydrate, C₃₈H₄₂F₂CuN₈O₁₂

September 17, 2016

Kuo Cui, Liang-Liang Wang, Wen-Wei Zhang, Fu-Xin Liu, Wen-Jun Zhang, Zhuo-Wen Fan

Page range: 1219-1220

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C 38 H 42 F 2 CuN 8 O 12 , triclinic, P 1̅ (no. 2), a = 5.4709(2) Å, b = 10.4100(4) Å, c = 17.3373(6) Å, α = 95.014(2)°, β = 92.041(2)°, γ = 103.223(2)°, V = 955.96(6) Å 3 , Z = 1, R gt ( F ) = 0.0347, wR ref ( F 2 ) = 0.1125, T = 296 K.
Open Access
Redetermination of the crystal structure of potassium lithium molybdate monohydrate, KLiMoO₄·H₂O

September 22, 2016

Garam Park, In-Hwan Oh, Su Kyeong Yu, Hyun-Min Park, Ho-Sung Kim

Page range: 1221-1222

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H 2 KLiMoO 5 , orthorhombic, Pbca (no. 61), a = 10.606(1) Å, b = 7.742(1) Å, c = 12.845(2) Å, V = 1054.8(2) Å 3 , Z = 8, R gt ( F ) = 0.0333, wR ref ( F 2 ) = 0.0749, T = 298(2) K.
Open Access
Crystal structure of [tris(2-benzimidazolylmethyl)amine-κ³N](isonicotinate-κO) cobalt(II) [tris(2-benzimidazolylmethyl)amine-κ³N](isonicotinic acid-κO) cobalt(II) triperchlorate, C₆₀H₅₁N₁₆O₁₆Cl₃Co₂

September 27, 2016

Ting-Ting Zhang, Guan-Nan Li, Feng-Mei Nie

Page range: 1223-1227

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C 60 H 51 N 16 O 16 Cl 3 Co 2 , monoclinic, P 2 1 / n (no. 14), a = 35.652(4) Å, b = 14.1314(16) Å, c = 25.141(3) Å, β = 105.113(2)°, V = 12228(3) Å 3 , Z = 8, R gt ( F ) = 0.0651, wR ref ( F 2 ) = 0.1663, T = 103(2) K.
Open Access
The crystal structure of tris(μ₂-1,3-bis(4,4,4-trifluoro-3-oxido-1-(oxo)but-2-en-1-yl)phenyl-κ⁴O,O′:O′′,O′′′)-bis(1,2-dimethoxyethane-κ²O,O′)dicerium(III), C₅₀H₃₈F₁₈O₁₆Ce₂

September 17, 2016

Yang Liu, Jing Shi, YanJun Hou, WenYi Chu, ZhiZhong Sun

Page range: 1229-1231

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C 50 H 38 F 18 O 16 Ce 2 , monoclinic, C 2/ c (no. 15), a = 15.589(3)Å, b = 13.118(2) Å, c = 29.118(5) Å, β = 92.285(2)°, V = 5949.8(18) Å 3 , Z = 4, R gt ( F ) = 0.0452, wR ref ( F 2 ) = 0.1321, T = 273 K.
Open Access
Crystal structure of 8-isopropyl-8-aza-bicyclo[3.2.1]octan-3-ol, C₁₀H₁₉NO

September 17, 2016

Xiao-Li Yang, Kun-Yan Wang

Page range: 1233-1234

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C 10 H 19 NO, monoclinic, P 2 1 / c (no. 14), a = 6.2427(16) Å, b = 9.553(2) Å, c = 16.932(4) Å, β = 100.094(7)°, V = 994.1(4) Å 3 , Z = 4, R gt ( F ) = 0.060, wR ref ( F 2 ) = 0.094, T = 296(2) K.
Open Access
Crystal structure of 2,4-dibenzoyl-N,N-dimethylbenzenamine, C₂₂H₁₉NO₂

September 17, 2016

Kai Wang, Qiang Chen, Jian Xiao

Page range: 1235-1236

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C 22 H 19 NO 2 , monoclinic, P 2 1 / c (no. 14), a = 12.7728(19) Å, b = 7.9765(12) Å, c = 20.451(3) Å, β = 123.946(7)°, V = 1728.5(5) Å 3 , Z = 4, R gt ( F ) = 0.049, wR ref ( F 2 ) = 0.150, T = 296(2) K.
Open Access
The crystal structure of 2-(4-methoxyphenyl)-6,8-diphenyl-4-(phenylamino)quinazoline — acetonitrile (1/1), C₃₅H₂₈N₄O

September 13, 2016

Marole M. Maluleka, Malose J. Mphahlele

Page range: 1237-1239

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C 35 H 28 N 4 O, triclinic, P 1̅ (no. 2), a = 10.5972(11) Å, b = 11.0497(12) Å, c = 12.0241(12) Å, α = 89.499(4)°, β = 77.169(4)°, γ = 79.758(4)°, V = 1350.2(2) Å 3 , Z = 2, R gt ( F ) = 0.0717, wR ref ( F 2 ) = 0.1542, T = 173 K.

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