Volume 237, Issue 3

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Zeitschrift für Kristallographie - New Crystal Structures

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Frontmatter

April 20, 2022

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New Crystal Structures
Open Access
Crystal structure of (E)-(4-imidazol-1-yl-phenyl)-(2-methoxy-benzylidene)-amine monohydrate, C₁₇H₁₇N₃O₂

March 10, 2022

Lufei Xiao, Jie Li, Qirui Liang, Jie Liu

Page range: 327-329

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C 17 H 17 N 3 O 2 , monoclinic, P 2 1 / c (no. 14), a = 10.655(5) Å, b = 5.056(5) Å, c = 28.712 Å, β = 99.034(1)°, V = 1527.6(17) Å 3 , Z = 4, R gt ( F ) = 0.0520, wR ref ( F 2 ) = 0.1611, T = 298(2) K.
Open Access
Crystal structure of 6-methyl-3-(pyrrolidine-1-carbonyl)-2H-chromen-2-one, C₁₅H₁₅N₁O₃

March 3, 2022

Jie Wang, Li-Sha Luo, Yu-Cong Deng, Zhong-Chao Li, Da-Yong Peng

Page range: 331-333

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C 15 H 15 N 1 O 3 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 7.1053(11) Å, b = 8.3014(12) Å, c = 11.0297(16) Å, α = 85.810(2)°, β = 79.896(2)°, γ = 87.055(2)°, V = 638.28(16) Å 3 , Z = 2, R gt ( F ) = 0.0371, wR ref ( F 2 ) = 0.1062, T = 296(2) K.
Open Access
Crystal structure of 4-methyl-4-nitropentanoic acid, C₆H₁₁NO₄

March 7, 2022

Hongjuan Tong, Wenqiang Tang

Page range: 335-337

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C 6 H 11 NO 4 , monoclinic, P 2 1 / c (no. 14), a = 19.1903(7) Å, b = 18.4525(6) Å, c = 9.2197(3) Å, β = 95.879(1)°, V = 3247.61(19) Å 3 , Z = 16, R gt ( F ) = 0.0495, wR ref ( F 2 ) = 0.1194, T = 173 K.
Open Access
The crystal structure of (E)-3-(furan-2-yl)acrylonitrile, C₇H₅NO

March 7, 2022

Lilei Zhang, Tianyu Mi

Page range: 339-340

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C 7 H 5 NO, monoclinic, P 2 1 / n (no. 14), a = 3.7589(5) Å, b = 19.493(2) Å, c = 8.4180(10) Å, V = 601.98(13) Å 3 , Z = 4, R gt ( F ) = 0.0502, wR ref ( F 2 ) = 0.1274, T = 170 K.
Open Access
Crystal structure of 3-(difluoromethyl)-1-methyl-N-(4,11,11-trimethyl-1,2,3,4-tetrahydro-1,4-methanoacridin-9-yl)-1H-pyrazole-4-carboxamide monohydrate, C₂₃H₂₆F₂N₄O₃

March 8, 2022

Liang Zhong, Jiu-Long Wang, Shuang-Shi Zhu, Shang-Xing Chen, Da-Yong Peng

Page range: 341-343

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C 23 H 26 F 2 N 4 O 3 , orthorhombic, P 2 1 2 1 2 1 (no. 19), a = 11.6524(10) Å, b = 11.9777(10) Å, c = 15.9058(13) Å, V = 2220.0(3) Å 3 , Z = 4, R gt ( F ) = 0.0305, wR ref ( F 2 ) = 0.0751, T = 296(2) K.
Open Access
Crystal structure of 2-(4-bromobenzyloxy)-6-chloropyridine, C₁₂H₉BrClNO

March 7, 2022

Zhi-Qiang Lu

Page range: 345-346

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C 12 H 9 BrClNO, monoclinic, P 2 1 / n (no. 14), a = 4.3665(3) Å, b = 22.5576(17) Å, c = 12.1286(10) Å, β = 99.028(7)°, V = 1179.84(16) Å 3 , Z = 4, R gt ( F ) = 0.0595, wR ref ( F 2 ) = 0.1451, T = 293 K.
Open Access
Crystal structure of N-(4-bromo-2,6-dichloro-phenyl)pyrazin-2-amine, C₁₀H₆BrCl₂N₃

March 7, 2022

Zhoujing Zhu, Bin Liu, Xiaona Xu

Page range: 347-349

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C 10 H 6 BrCl 2 N 3 , monoclinic, P 2 1 / c (no. 14), a = 9.2229(13) Å, b = 14.709(2) Å, c = 8.6472(13) Å, β = 104.851(3)°, V = 1133.9(3) Å 3 , Z = 4, R gt ( F ) = 0.0312, wR ref ( F 2 ) = 0.0839, T = 173 K.
Open Access
Crystal structure of (E)-1-(2–nitrophenyl)-3-phenylprop-2-en-1-one, C₁₅H₁₁NO₃

March 7, 2022

Marole M Maluleka, Malose J Mphahlele

Page range: 351-353

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C 15 H 11 NO 3 , P 2 1 / c (no. 14), a = 5.4092(2) Å, b = 23.9605(8) Å, c = 9.4887(3) Å, β = 96.080(1)°, V = 1222.89(7) Å 3 , Z = 4, R gt ( F ) = 0.0358, w R ref ( F 2 ) = 0.0888, T = 173(2) K.
Open Access
The crystal structure of (E)-3-chloro-2-(2-(4-fluorobenzylidene)hydrazinyl)pyridine, C₁₂H₉Cl_FN₃

March 1, 2022

Bin-Yu Zheng, Na-Bo Sun, Xue-Song Chen, Xing-Hai Liu

Page range: 355-356

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C 12 H 9 Cl F N 3 , monoclinic, P 2 1 / n (no. 14), a = 10.120(4) Å, b = 13.823(6) Å, c = 16.480(7) Å, β = 91.744(8)°, V = 2304.4(17) Å 3 , Z = 8, R gt ( F ) = 0.0402, wR ref ( F 2 ) = 0.0932, T = 113.15 K.
Open Access
Crystal structure of (E)-amino(2-(thiazol-2-ylmethylene)hydrazineyl)methaniminium nitrate, C₁₀H₁₆N₁₂O₆S₂

March 7, 2022

Ze-Sen Jin, E. Liu, Xiao-jing Liu, Zhuang-yu Li, Fang-fang Jian, Tongling Liang

Page range: 357-359

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C 10 H 16 N 12 O 6 S 2 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 7.6977(2) Å, b = 11.5353(3) Å, c = 11.7533(3) Å, α = 67.973(2)°, β = 87.916(2)°, γ = 88.347(2)°, V = 966.69(5) Å 3 , Z = 2, R gt ( F ) = 0.0290, wR ref ( F 2 ) = 0.0818, T = 170K.
Open Access
Crystal structure of 9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrido [1′,2′:1,6]pyrazino[2,3-b]quinoxaline, C₁₅H₁₈N₄O

March 7, 2022

Qiu Yu Zhang, Yu Yu

Page range: 361-363

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C 15 H 18 N 4 O, triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 6.7562(5) Å, b = 9.5520(6) Å, c = 11.4227(8) Å, α = 97.206(5)°, β = 102.335(6)°, γ = 108.614(7)°, V = 667.39(9) Å 3 , Z = 2, R gt ( F ) = 0.0480, wR ref ( F 2 ) = 0.1388, T = 150 K.
Open Access
The crystal structure bis(dimethylsulfoxide-κ¹O)-dipyridine-κ¹ N-bis(m₂-(Z)-3-methyl-2-oxido-N-((Z)-oxido(phenyl)methylene)benzohydrazonato-κ⁵)trinickel(II) - dimethylsulfoxide (1/2), C₄₈H₅₆N₆Ni₃O₁₀S₄

March 7, 2022

Liguo Yang, Xin Wang, Kun Zou, Shuige Hu, Xiaozhen Liu

Page range: 365-367

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C 48 H 56 N 6 Ni 3 O 10 S 4 , monoclinic, P 2 1 (no. 4), a = 12.3887(11) Å, b = 15.7405(13) Å, c = 13.4254(11) Å, β = 97.364(2)°, V = 2596.4(4) Å 3 , Z = 2, R gt ( F ) = 0.0530, wR ref ( F 2 ) = 0.1316, T = 298 K.
Open Access
Crystal structure of bis(bis(triphenylphosphine)iminium) tetradecacarbonyltetratelluridopentaferrate(2-), (PPN)₂[Fe₅Te₄(CO)₁₄]

March 7, 2022

Kang-Woo Kim, Hyoyi Yang

Page range: 369-372

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C 86 H 60 O 14 N 2 P 4 Fe 5 Te 4 , triclinic, P 1 ‾ $P\overline{1}$ (No. 2), a = 13.6807(7) Å, b = 18.5116(11) Å, c = 19.3210(10) Å, α = 78.170(2)°, β = 70.1007(18)°, γ = 70.5341(19)°, V = 4314.7(4) Å 3 , Z = 2, R gt ( F ) = 0.0411, wR ref ( F 2 ) = 0.1234, T = 223 K.
Open Access
Crystal structure of 4-Hydroxy-3-(naphthalen-2-ylthio)pent-3-en-2-one, C₁₅H₁₄O₂S

March 22, 2022

Ya-Xin Wen, Ya-Fei Guo, Le Dong, Jun-Ying Ma, Bing-You Fan

Page range: 373-375

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C 15 H 14 O 2 S, monoclinic, P 2 1 / c (no. 14), a = 13.5881(11) Å, b = 7.3129(9) Å, c = 13.3284(11) Å, β = 96.125(7)°, V = 1316.9(2) Å 3 , Z = 4, R gt ( F ) = 0.0570, wR ref ( F 2 ) = 0.1402, T = 293 K.
Open Access
The crystal structure of [(1,10-phenanthroline-κ² N,N)-bis(6-phenylpyridine-2-carboxylate-κ² N,O)nickel(II)] monohydrate, C₃₆H₂₆N₄O₅Ni

March 15, 2022

Li-Hua Wang, Xi-Shi Tai, Xiu-Jie Ren

Page range: 377-379

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C 36 H 26 N 4 O 5 Ni, orthorhombic, P 2 1 2 1 2 1 (no. 19), a = 10.5860(9) Å, b = 10.6497(6) Å, c = 26.4492(15) Å, β = 90°, V = 2981.8(3) Å 3 , Z = 4, R gt ( F ) = 0.0341, wR ref ( F 2 ) = 0.0703, T = 200 K.
Open Access
Crystal structure of 3,3′-(pyridine-2,6-diylbis(methylene))bis(1-propyl-1H-imidazol-3-ium) ditetrafluoroborate, C₁₉H₂₇B₂F₈N₅

March 16, 2022

David O. Ywaya, Holger B. Friedrich, Muhammad D. Bala, Lynette Soobramoney, Halliru Ibrahim

Page range: 381-383

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C 19 H 27 N 5 , orthorhombic Pbca (no. 61), a = 9.8515(12) Å, b = 16.508(2) Å, c = 29.817(3) Å, β = 90°, V = 4849.3(10) Å 3 , Z = 8, R gt ( F ) = 0.0409, wR ref ( F 2 ) = 0.1082.
Open Access
The crystal structure of (E)-1-(4-aminophenyl)-3-(p-tolyl)prop-2-en-1-one, C₁₆H₁₅NO

March 17, 2022

Jingxiao Zhang, Jinyu Lv, Jiajia Wang

Page range: 385-387

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C 16 H 15 NO, monoclinic, P 2 1 / c (no. 14), a = 5.9233(3) Å, b = 14.5788(9) Å, c = 14.7095(9) Å, β = 99.073(2)°, V = 1254.34(13) Å 3 , Z = 4, R gt ( F ) = 0.0600, wR ref ( F 2 ) = 0.1512, T = 170 K.
Open Access
The crystal structure of poly[(μ₂-terephthalato-κ⁴O,O′: O″,O‴)-(μ₄-terephthalato-κ⁴O:O′:O″:O‴)-{μ₄-(1,2,4,5-tetrakis(1,2,4-triazol-1-ylmethyl)-benzene-κ⁴O:O′:O″,O‴)}dicadmium(II)] – water – acetronitrile (1/2/2), C₃₈H₃₆N₁₄O₁₀Cd₂

March 16, 2022

Hua-Rui Wang

Page range: 389-391

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C 38 H 36 N 14 O 10 Cd 2 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 10.220(2) Å, b = 10.685(2) Å, c = 10.777(2) Å, α = 84.18(3)°, β = 72.02(3)°, γ = 75.28(3)°, V = 1082.3(4) Å 3 , Z = 1, R gt ( F ) = 0.0268, wR ref ( F 2 ) = 0.0732, T = 293(2) K.
Open Access
The crystal structure of diaqua-bis(6-phenylpyridine-2-carboxylato-κ² N,O)cobalt(II)–water–N,N-dimethylformamide(1/2/1), C₂₇H₃₁N₃O₉Co

March 16, 2022

Xiang Gao, Xi-Shi Tai

Page range: 393-395

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C 27 H 31 N 3 O 9 Co, monoclinic, P 2 1 / n (no. 14), a = 10.9230(6) Å, b = 11.1166(8) Å, c = 22.8312(15) Å, β = 93.404(6)°, V = 2767.4(3) Å 3 , Z = 4, R gt ( F ) = 0.0349, wR ref ( F 2 ) = 0.0893, T = 200 K.
Open Access
The co-crystal structure of 4-hydroxy-3-methoxybenzoic acid – 4,4′-bipyridine, C₈H₈O₄·C₁₀H₈N₂

March 16, 2022

Devin J. Angevine, Jason B. Benedict

Page range: 397-398

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C 8 H 8 O 4 ·C 10 H 8 N 2 , monoclinic, P 2 1 / c (no. 14), a = 13.427(4) Å, b = 10.069(3) Å, c = 12.751(4) Å, β = 116.124(7)°, V = 1547.7(8) Å 3 , Z = 4, R gt ( F ) = 0.0426, wR ref ( F 2 ) = 0.1152, T = 90 K.
Open Access
Crystal structure of catena-poly[(μ₂-1,1′-(biphenyl-4,4′-diyl)bis(1H-imidazol)-κ²N:N′)-bis(4-bromobenzoate-κ¹O)cobalt(II)], C₃₂H₂₂Br₂CoN₄O₄

March 16, 2022

Xin Zhuo

Page range: 399-401

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C 32 H 22 Br 2 CoN 4 O 4 , monoclinic, P 2 1 / c (no. 4), a = 6.5529(11) Å, b = 24.375(4) Å, c = 18.379(3) Å, β = 97.491(3)°, V = 2910.6(8) Å 3 , Z = 4, R gt ( F ) = 0.0404, wR ref ( F 2 ) = 0.1268, T = 296(2) K.
Open Access
Crystal structure of (E)-5-propyl-4-((pyridin-2-ylmethylene)amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione – methanol (1/1), C₁₁H₁₃N₅S

March 16, 2022

Huijuan Jia, Zhen Dong, Xiaoyan Qin, Yiying Song, Zhibin Zhou, Caixia Yuan

Page range: 403-405

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C 11 H 13 N 5 S, monoclinic, P 2 1 / c (no. 14), a = 7.2720(14) Å, b = 11.631(2) Å, c = 17.031(3) Å, β = 95.12(3)°, V = 1434.7(5) Å 3 , Z = 4, R gt ( F ) = 0.0353, wR ref ( F 2 ) = 0.0953, T = 293 K.
Open Access
The crystal structure of (Z)-4-bromo-6-(((1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)amino)methylene)cyclohexa-2,4-dien-1-one monohydrate, C₁₁H₁₆BrNO₅

March 22, 2022

Hai-Bo Qin, Ke-Xiang Liu, Xu Fan, Zhong-Yan Li, Lin Yuan

Page range: 407-408

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C 11 H 16 BrNO 5 , monoclinic, P 2 1 / c (no. 14), a = 15.164(7) Å, b = 11.798(5) Å, c = 7.359(3) Å, β = 90.792°, V = 1316.4(10) Å 3 , Z = 4, R gt ( F ) = 0.0322, wR ref ( F 2 ) = 0.0797, T = 296(2) K.
Open Access
Crystal structure of bis(tetrapropylammonium) nonaselenidotetrastannate(IV), (Pr₄N)₂[Sn₄Se₉]

March 22, 2022

Kang–Woo Kim

Page range: 409-411

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C 24 H 56 N 2 Sn 4 Se 9 , monoclinic, P 2 1 / n (no. 14), a = 15.3276(10) Å, b = 19.0577(15) Å, c = 15.3980(11) Å, β = 97.947(3)°, V = 4454.7(6) Å 3 , Z = 4, R gt ( F ) = 0.0313, wR ref ( F 2 ) = 0.0686, T = 223 K.
Open Access
Crystal structure of 2,6-di-tert-butyl-4-(4-chlorobenzylidene)cyclohexa-2,5-dien-1-one, C₂₁H₂₅ClO

March 22, 2022

Yue Ding, Hongying Wang, Qin Zheng, Jiaojie Guo, Guangbo Zhang, Jing Wang, Xiumin Wang, Haibo Guo

Page range: 413-415

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C 21 H 25 ClO, orthorhombic, Pna 2 1 (no. 33), a = 14.152(2) Å, b = 22.112(3) Å, c = 6.0109(7) Å, V = 1880.9(4) Å 3 , Z = 4, R gt ( F ) = 0.0586, wR ref ( F 2 ) = 0.1227, T = 150 K.
Open Access
Crystal structure of (2,2′-((naphthalen-1-ylmethyl)azanediyl)diacetato-κ³ N,O,O′)-(1,10-phenanthroline-κ² N,N′)-copper(II) trihydrate, CuC₂₇H₂₇N₃O₇

March 22, 2022

Xingman Xu, Renqiang Sun

Page range: 417-419

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CuC 27 H 27 N 3 O 7 , orthorhombic, Pca 2 1 (no. 29), a = 22.9142(18) Å, b = 7.3271(6) Å, c = 14.7386(11) Å, V = 2474.5(3) Å 3 , Z = 4, R gt ( F ) = 0.0443, wR ref ( F 2 ) = 0.0990, T = 294(2) K.
Open Access
The crystal structure of tetrakis(6-phenylpyridine-2-carboxylato-κ²N,O)-bis(1H-pyrazol-3-ylamine-κ² N:N)dicobalt(II) dihydrate, C₂₇H₂₃N₅O₅Co

March 22, 2022

Gao Xiang, Tai Xi-Shi

Page range: 421-423

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C 27 H 23 N 5 O 5 Co, triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 8.6503(7) Å, b = 11.1188(8) Å, c = 13.2711(11) Å, α = 79.185(7)°, β = 71.970(7)°, γ = 87.951(6)°, V = 1191.85(17) Å 3 , Z = 2, R gt ( F ) = 0.0450, wR ref ( F 2 ) = 0.1143, T = 200 K.
Open Access
The crystal structure of bis((E)-2-((tert-butylimino)methyl)-4-chlorophenolato-κ²N,O)zinc(II), C₂₂H₂₆Cl₂N₂O₂Zn

March 22, 2022

Qian-Zhi Yang, Yu-Xin Yang, Jin-Hao Kuang, Zhong-Yan Li, Lin Yuan

Page range: 425-427

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C 22 H 26 Cl 2 N 2 O 2 Zn, monoclinic, P 2 1 / n (no. 14), a = 10.488(7) Å, b = 10.139(7) Å, c = 22.760(15) Å, β = 99.705°, V = 2386(3) Å 3 , Z = 4, R gt ( F ) = 0.0395, wR ref ( F 2 ) = 0.1053, T = 296(2) K.
Open Access
The crystal structure of poly[diaqua-(μ₃-5-nitrobenzene-1,2,3-tricarboxylato-κ³O:O′:O′)-(μ₂-4,4′-dipyridylamine-κ²N:N′)copper(II)], C₃₈H₃₀Cu₃N₈O₂₀

March 24, 2022

Dong-Feng Hong, Ye Chen, Wen-Li Zhu

Page range: 429-431

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C 38 H 30 Cu 3 N 8 O 20 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 7.2659(3) Å, b = 11.7245(3) Å, c = 12.6837(4) Å, α = 77.466(3)°, β = 73.915(3)°, γ = 75.794(3)°, V = 993.50(6) Å 3 , Z = 1, R gt ( F ) = 0.0334, wR ref ( F 2 ) = 0.0842, T = 291 K.
Open Access
The crystal structure of (E)-1-ferrocenyl-3-(naphthalen-1-yl)prop-2-en-1-one, C₂₃H₁₈FeO

March 24, 2022

Jingxiao Zhang, Fengge Gao, Linyue Qi, Xia Yin

Page range: 433-435

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C 23 H 18 FeO, orthorhombic, Pna 2 1 (no. 33), a = 28.3217(11) Å, b = 5.7477(2) Å, c = 10.3071(3) Å, β = 90°, V = 1677.84(10) Å 3 , Z = 4, R gt ( F ) = 0.0372, wR ref ( F 2 ) = 0.0713, T = 150 K.
Open Access
The crystal structure of (E)-1-ferrocenyl-3-(4-isopropylphenyl)prop-2-en-1-one, C₂₂H₂₂FeO

March 23, 2022

Jingxiao Zhang, Xiangjie Hu, Xianghui Liu, Yifan He

Page range: 437-439

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C 22 H 22 FeO, monoclinic, P 2 1 (no. 4), a = 10.204(3) Å, b = 5.7956(16) Å, c = 14.591(4) Å, β = 97.876(10)°, V = 854.7(4) Å 3 , Z = 2, R gt ( F ) = 0.0676, wR ref ( F 2 ) = 0.1647, T = 170 K.
Open Access
Crystal structure of 6-hydroxy-2,2-dimethyl-4Hbenzo[d][1,3]dioxin-4-one, C₁₀H₁₀O₄

March 23, 2022

Wenqiang Tang, Xiaona Xu, Yanrong Gao, Hongjuan Tong, Zhoujing Zhu, Bin Liu

Page range: 441-443

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C 10 H 10 O 4 , monoclinic, P 2 1 / c (no. 14), a = 9.464(6) Å, b = 10.302(7) Å, c = 10.589(7) Å, β = 114.174(11)°, V = 941.8(10) Å 3 , Z = 4, R gt ( F ) = 0.0453, wR ref ( F 2 ) = 0.1394, T = 173 K.
Open Access
The crystal structure of (2E,4E)-1-ferrocenyl-5-phenylpenta-2,4-dien-1-one, C₂₁H₁₈FeO

March 24, 2022

Jingxiao Zhang, Xuezhen Huang

Page range: 445-447

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C 21 H 18 FeO, monoclinic, P 2 1 / c (no. 14), a = 5.8577(3) Å, b = 11.2160(5) Å, c = 24.1507(11) Å, β = 92.803(2)°, V = 1584.80(13) Å 3 , Z = 4, R gt ( F ) = 0.0383, wR ref ( F 2 ) = 0.0755, T = 170 K.
Open Access
Crystal structure of alaninato-κ²N,O-bis(hydroxylamido-κ²N,O)-oxido-vanadium(V), C₃H₁₀N₃O₅V

March 23, 2022

Heng-Qiang Zhang, Xia Juan, Xu Ning, Fu-Jian Fang, Xin Yang, Xiu-Jun Zheng

Page range: 449-451

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C 3 H 10 N 3 O 5 V, monoclinic, P 2 1 / c (no. 14), a = 5.487(2) Å, b = 7.611(3) Å, c = 19.629(8) Å, β = 101.269(11)°, V = 803.9(5) Å 3 , Z = 4, R gt ( F ) = 0.0375, wR ref ( F 2 ) = 0.0866, T = 293(2) K.
Open Access
Crystal structure of catena-poly[aqua-bis[μ₂-6-(1H-imidazol-1-yl)nicotinato-κ² N,O]copper(II)], C₁₈H₁₄N₆O₅Cu

March 23, 2022

Dong-Feng Hong, Meng-Fei Li, Tian-Tian Chu

Page range: 453-454

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C 18 H 14 N 6 O 5 Cu, monoclinic, C 2/ c (no. 15), a = 14.1337(5) Å, b = 5.8568(2) Å, c = 21.2295(6) Å, β = 105.074(3)°, V = 1696.87(10) Å 3 , Z = 4, R gt ( F ) = 0.0239, wR ref ( F 2 ) = 0.0603, T = 293 K.
Open Access
Crystal structure of diethyl 4,6-diphenyl-1,9-di-p-tolylhexahydro-3H-2,7,3,5-(epimethanetriyliminomethanetriyl)cyclopenta[b]pyridine-3,5(2H)-dicarboxylate, C₄₂H₄₂N₂O₄

April 4, 2022

Shuai Fan, Qian Zhang, Xu-Dong Lv, Yuan-Yuan Jin, Zhao-Yong Yang

Page range: 455-457

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C 42 H 42 N 2 O 4 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 9.309(3) Å, b = 14.191(5) Å, c = 14.918(5) Å, α = 69.221(4)°, β = 82.384(5)°, γ = 72.805(4)°, V = 1759.3(10) Å 3 , Z = 2, R gt ( F ) = 0.0699, wR ref ( F 2 ) = 0.1806, T = 296 K.
Open Access
The crystal structure of cobalt cadmium bis(hydrogenphosphate) bis(phosphate(V)) tetrahydrate, H₁₀O₂₀P₄Co_3.14Cd_1.86

April 4, 2022

Xiu-Hua Zhang, Jin-Xiao Mi, Zhi-Biao Hu, Ze-Hai Qiu, Wu-Hua Chen

Page range: 459-461

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H 10 O 20 P 4 Co 3.14 Cd 1.86 , monoclinic, C 2/ c (no. 15), a = 17.5779(6) Å, b = 9.0747(3) Å, c = 9.4946(3) Å, β = 96.636(3)°, V = 1504.38(9) Å 3 , Z = 1, R gt ( F ) = 0.0273, wR ref ( F 2 ) = 0.0646, T = 293(2) K.
Open Access
Crystal structure of dimethyl 1,4,6,9-tetraphenylhexahydro-3H-2,7,3,5-(epimethanetriyliminomethanetriyl)cyclopenta[b]pyridine-3,7(2H)-dicarboxylate, C₃₈H₃₄N₂O₄

April 4, 2022

Yin-Xin Wang, Si-Qi Geng, Jia-Rui Qin, Wen-Li Zhang, Qi-Di Zhong

Page range: 463-465

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C 38 H 34 N 2 O 4 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 11.1158(19) Å, b = 11.302(2) Å, c = 12.634(2) Å, α = 72.109(2)°, β = 77.410(2)°, γ = 82.648(3)°, V = 1362.4(5) Å 3 , Z = 2, R gt ( F ) = 0.0473, wR ref ( F 2 ) = 0.1738, T = 296 K.
Open Access
Crystal structure of (Z)-4-(furan-2-yl((4-iodophenyl)amino)methylene)-5-methyl-2(p-tolyl)-2,4-dihydro-3H-pyrazol-3-one, C₂₁H₁₆I N₃O₂

April 5, 2022

Zhang Li, Wu Qiong, Tong-Yin Jin, Ya-Zhai Zhang, Xiao-Zhong Wang, Heng-Qiang Zhang

Page range: 467-469

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C 21 H 16 I N 3 O 2 , monoclinic, P 2 1 / c (no. 14), a = 12.7439(9) Å, b = 11.8391(8) Å, c = 13.4459(7) Å, β = 99.803(5)°, V = 1999.0(2) Å 3 , Z = 4, R gt ( F ) = 0.0365, wR ref ( F 2 ) = 0.0905, T = 293(2) K.
Open Access
Crystal structure of (E)-1-(4-(3,5-dimethoxystyryl)phenyl)-7-ethylheptanedioate, C₂₅H₃₀O₆

April 4, 2022

Lilei Zhang, Jiamin Hu, Yumeng Qiao

Page range: 471-473

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C 25 H 30 O 6 , orthorhombic, Pna 2 1 (no. 33), a = 7.556(2) Å, b = 37.198(12) Å, c = 8.113(2) Å, V = 2280.2(11) Å 3 , Z = 4, R gt ( F ) = 0.0610, wR ref ( F 2 ) = 0.1634, T = 170 K.
Open Access
Crystal structure of 6-bromo-2-(4-chlorophenyl)chroman-4-one (6-bromo-4′-chloroflavanone), C₁₅H₁₀BrClO₂

April 5, 2022

Marole M. Maluleka, Malose J. Mphahlele

Page range: 475-477

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C 15 H 10 BrClO 2 monoclinic P 2 1 / c (no. 14), a = 9.2173(6) Å, b = 20.7174(14) Å, c = 6.9035(4) Å, β = 99.332(3)°, V = 1300.83(14) Å 3 , Z = 4, R gt ( F ) = 0.0153, w R ref ( F 2 ) = 0.121, T = 173(2) K.
Open Access
The crystal structure of 2-(benzhydryloxy)-3-nitropyridine, C₁₈H₁₄N₂O₃

April 6, 2022

Zhi-Qiang Lu

Page range: 479-480

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C 18 H 14 N 2 O 3 , monoclinic, P 2 1 / n (no. 14), a = 8.1644(3) Å, b = 14.5766(6) Å, c = 12.9462(4) Å, β = 91.902(3)°, V = 1539.87(10) Å 3 , Z = 4, R gt ( F ) = 0.0456, ωR ref ( F 2 ) = 0.1400, T = 293(2) K.
Open Access
The crystal structure of 1,3(4,1)-dipyridin-1-iuma-2(1,8)-diethynylanthracena-5(1,3)-benzenacyclohexaphane-11,31-diium bis(hexafluoridophosphate), C₃₆H₂₄F₁₂N₂P₂

April 6, 2022

Xia Hu, Fei Zeng

Page range: 481-483

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C 36 H 24 F 12 N 2 P 2 , triclinic, P 1 ‾ $\overline{1}$ (no. 2), a = 8.218(7) Å, b = 10.384(9) Å, c = 19.908(17) Å, α = 96.402(12)°, β = 91.216(12)°, γ = 101.161(12)°, V = 1655(2) Å 3 , Z = 2, R gt ( F ) = 0.0685, wR ref ( F 2 ) = 0.2188, T = 296(2) K.
Open Access
Crystal structure of 3,6-di-tert-butyl-1-iodo-9-methyl-8-(pyren-1-ylethynyl)-9H-carbazole, C₃₉H₃₄IN

April 6, 2022

Xin Hu, Guo-Kai Jia, Man-Hua Ding

Page range: 485-487

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C 39 H 34 IN, monoclinic, P 2 1 / m (no. 11), a = 11.651(2) Å, b = 7.0023(14) Å, c = 18.716(4) Å, β = 97.5°, V = 1513.8(5) Å 3 , Z = 2, R gt ( F ) = 0.0410, w R ref ( F 2 ) = 0.1056, T = 296(2) K.
Open Access
The cocrystal 2-(dimethylammonio)-5-nitrobenzoate – 2-(dimethylamino)-5-nitrobenzoic acid, C₉H₁₀N₂O₄

April 7, 2022

Jianqiang Cui, Jing Men, Bin Liu

Page range: 489-491

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C 9 H 10 N 2 O 4 , triclinic, P 1 ‾ $P\overline{1}$ (no. 2), a = 9.722(2) Å, b = 10.805(2) Å, c = 10.947(2) Å, α = 67.938(4)°, β = 66.250(4)°, γ = 72.978(4)°, V = 961.8(3) Å 3 , Z = 4, R gt ( F ) = 0.0421, wR ref ( F 2 ) = 0.1339, T = 173 K.
Open Access
Crystal structure of 5-nitroquinazolin-4(3H)-one, C₈H₅N₃O₃

April 8, 2022

Lei Shi, Yu-Jiang Wang, Jun-Chao An, Bin Li, Ji Hu

Page range: 493-495

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C 8 H 5 N 3 O 3 , monoclinic, P 2 1 / c (no. 14), a = 9.1778(16) Å, b = 7.0270(10) Å, c = 12.518(2) Å, β = 92.930(6)°, V = 806.3(2) Å 3 , Z = 4, R gt ( F 2 ) = 0.0469, wR ref ( F 2 ) = 0.1353, T = 298 K.

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