Abstract
C12H20Cl2N4Zn, monoclinic, P21/n (no. 14), a = 9.9915(9) Å, b = 13.0923(12) Å, c = 13.1894(13) Å, β = 98.794(2)°, V = 1705.0(3) Å3, Z = 4, Rgt(F) = 0.0453, wRref(F2) = 0.1248, T = 298(2) K.
The molecular structure is shown in the Figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.

Data collection and handling.
Crystal: | White block |
Size: | 0.26 × 0.24 × 0.21 mm |
Wavelength: | Mo Kα radiation (0.71073 Å) |
μ: | 1.75 mm−1 |
Diffractometer, scan mode: | φ and ω |
θmax, completeness: | 25.0°, >99% |
N(hkl)measured, N(hkl)unique, Rint: | 8268, 2985, 0.046 |
Criterion for Iobs, N(hkl)gt: | Iobs > 2 σ(Iobs), 1973 |
N(param)refined: | 174 |
Programs: | Bruker [1], SHELX [2] |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).
Atom | X | Y | z | Uiso*/Ueq |
---|---|---|---|---|
Zn1 | 1.03894 (5) | 0.77306 (4) | 0.45279 (4) | 0.0469 (2) |
N1 | 0.9173 (4) | 0.7500 (3) | 0.5592 (3) | 0.0519 (10) |
N2 | 0.8331 (4) | 0.6768 (4) | 0.6849 (3) | 0.0610 (11) |
N3 | 0.9372 (4) | 0.8306 (3) | 0.3234 (3) | 0.0520 (10) |
N4 | 0.8253 (4) | 0.9382 (3) | 0.2150 (3) | 0.0624 (11) |
Cl1 | 1.11689 (13) | 0.61988 (9) | 0.41220 (9) | 0.0603 (4) |
Cl2 | 1.19362 (14) | 0.88879 (10) | 0.51772 (10) | 0.0667 (4) |
C1 | 0.9075 (5) | 0.6651 (4) | 0.6103 (4) | 0.0576 (13) |
H1 | 0.947834 | 0.603798 | 0.595958 | 0.069* |
C2 | 0.8444 (6) | 0.8196 (4) | 0.6033 (4) | 0.0713 (15) |
H2 | 0.831500 | 0.887295 | 0.582735 | 0.086* |
C3 | 0.7929 (6) | 0.7756 (5) | 0.6818 (5) | 0.0783 (17) |
H3 | 0.740312 | 0.807061 | 0.725105 | 0.094* |
C4 | 0.8024 (6) | 0.5989 (5) | 0.7587 (5) | 0.0833 (18) |
H4A | 0.749356 | 0.630487 | 0.805942 | 0.100* |
H4B | 0.746949 | 0.546195 | 0.721550 | 0.100* |
C5 | 0.9238 (9) | 0.5497 (6) | 0.8194 (5) | 0.113 (3) |
H5A | 0.892115 | 0.502770 | 0.867505 | 0.136* |
H5B | 0.967772 | 0.509108 | 0.772566 | 0.136* |
C6 | 1.0226 (9) | 0.6130 (6) | 0.8751 (7) | 0.136 (3) |
H6A | 1.065441 | 0.653127 | 0.828262 | 0.204* |
H6B | 1.089219 | 0.571617 | 0.916245 | 0.204* |
H6C | 0.980435 | 0.657502 | 0.918710 | 0.204* |
C7 | 0.8884 (5) | 0.9235 (4) | 0.3097 (4) | 0.0621 (14) |
H7 | 0.897184 | 0.973325 | 0.360600 | 0.075* |
C8 | 0.9015 (6) | 0.7828 (4) | 0.2290 (4) | 0.0648 (14) |
H8 | 0.921617 | 0.715726 | 0.213854 | 0.078* |
C9 | 0.8335 (6) | 0.8494 (4) | 0.1638 (4) | 0.0730 (16) |
H9 | 0.798240 | 0.836998 | 0.095544 | 0.088* |
C10 | 0.7603 (7) | 1.0330 (5) | 0.1736 (6) | 0.096 (2) |
H10A | 0.693603 | 1.015798 | 0.114661 | 0.115* |
H10B | 0.711949 | 1.062172 | 0.225136 | 0.115* |
C11 | 0.8440 (9) | 1.1059 (8) | 0.1446 (10) | 0.181 (5) |
H11A | 0.785477 | 1.152842 | 0.101589 | 0.217* |
H11B | 0.878038 | 1.143253 | 0.206749 | 0.217* |
C12 | 0.9591 (12) | 1.0904 (7) | 0.0932 (8) | 0.184 (5) |
H12A | 1.025693 | 1.050246 | 0.135883 | 0.277* |
H12B | 0.997435 | 1.155350 | 0.079743 | 0.277* |
H12C | 0.931148 | 1.055318 | 0.029579 | 0.277* |
Source of material
A solution of vanadiumoxy acetylacetonate (0.5 mmol) in H2O (10 mL) was successivley added 1-propylimidazole (6 mmol) and zinc chloride (0.5 mmol), and then maintained for 4 h at 60 °C with consistent stirring, and then filtered hot. The filtrate was left to slowly evaporate at room temperature for 3 days, and then the precipitated orange green rod crystals of the title compound were filtered off. Yield: 35.2%. Anal. Calcd. for C12H20Cl2N4Zn: C, 40.42; H, 5.65; N, 15.71; found: C, 40.59; H, 5.63; N, 15.67.
Experimental details
All hydrogen atomic positions were taken from a difference Fourier map. Hydrogen atoms were assigned with common isotropic displacement factors Uiso(H) = 1.2 times Ueq(C, imidazole ring and methylene carbon) and Uiso(H) = 1.5 times Ueq(C, methyl carbon). All the H atoms were refined as riding on their parent atom.
Comment
In the present scenario, zinc complexes have attracted interest owing to their bio-compatibility, low cost, varying coordination numbers and geometries, thermodynamic stability and catalytic properties [3], [4]. Up to date, lots of outstanding work about organic–inorganic hybrid zinc complexes have been presented, especially in the field of metal-organic frameworks [5], [6], [7]. Additionally, imidazole derivatives as a class of versatile ligands can be used not only as solvent, but also as ligands and organic base in the preparation of organic–inorganic hybrid materials, including some polyoxometalates [8], [9], [10].
The molecular structure of the title zinc complex is shown in the figure. Single crystal X-ray diffraction analysis demonstrates that the asymmetric unit of the title structure contains one zinc(II) cation, two 1-propylimidazole ligands and two chlorido ligands. The bond distances of Zn–N are 1.995(4) to 2.015(4) Å, bond lengths of Zn–Cl are 2.2390(13) and 2.2456(13) Å, respectively, which are similar with those of the reported dichloro-bis(1-octadecylimidazole)zinc compound [11]. In the title complex, the bond angles of N(3)–Zn(1)–N(1), N(1)–Zn(1)–Cl(2), N(3)–Zn(1)–Cl(2), N(3)–Zn(1)–Cl(1), Cl(2)–Zn(1)–Cl(1) and N(1)–Zn(1)–Cl(1) are 111.69(16)°, 106.83(11)°, 107.67(12)°, 106.33(12)°, 116.83(5)° and 107.47(12)°, respectively, which suggests a distorted tetrahedral geometry. Additionally, there are intermolecular weak C–H…Cl hydrogen-bonding interactions between adjacent complex molecules.
Funding source: Research on Experimental Technology of Liaocheng University
Award Identifier / Grant number: 263222017215
Award Identifier / Grant number: 263222017214
Funding source: Entrepreneurship Training Program for College Students
Award Identifier / Grant number: CXCY2020Y021
Award Identifier / Grant number: S202010447012X
Award Identifier / Grant number: X202010447012X
Author contribution: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.
Research funding: Research on Experimental Technology of Liaocheng University (263222017215 and 263222017214) and Entrepreneurship Training Program for College Students (CXCY2020Y021, S202010447012X and X202010447012X).
Conflict of interest statement: The authors declare no conflicts of interest regarding this article.
References
1. Bruker. APEX2, SAINT and SADABS; Bruker AXS Inc.: Madison, Wisconsin, USA, 2004.Suche in Google Scholar
2. Sheldrick, G. M. Crystal structure refinement with SHELXL. Acta Crystallogr. 2015, C71, 3–8. https://doi.org/10.1107/s2053229614024218.Suche in Google Scholar
3. Li, C., Yan, C., Yang, X., Ren, Y., Xue, Z., Cui, C., Huang, X. Two 2,4-dihydroxylsalicylideneglycine Schiff base complexes synthesis, structures and selective oxidation catalytic properties for alcohols. Chin. J. Inorg. Chem. 2016, 32, 891–898.Suche in Google Scholar
4. Wang, J., Wang, X., Xu, H., Zhao, X., Zheng, Z., Xu, Z. L. A zinc(II) porous metal-organic framework and its morphologically controlled catalytic properties in the Knoevenagel condensation reaction. ChemPlusChem 2017, 82, 1182–1187. https://doi.org/10.1002/cplu.201700327.Suche in Google Scholar
5. Ablott, T. A., Telfer, S. G., Richardson, C. A post-synthetically reduced borane-functionalised metal-organic framework with oxidation-inhibiting reactivity. CrystEngComm 2020, 22, 5289–5295. https://doi.org/10.1039/d0ce00930j.Suche in Google Scholar
6. Huang, X., Chen, Y., Lin, Z., Ren, X., Song, Y., Xu, Z., Li, X., Hu, C., Wang, B. Zn-BTC MOFs with active metal sites synthesized via structural-directing approach for highly efficient carbon conversion. Chem. Commun. 2014, 50, 2624–2627. https://doi.org/10.1039/c3cc49187k.Suche in Google Scholar
7. Ye, Y., Du, J., Sun, L., Liu, Y., Wang, S., Song, X., Liang, Z. Two zinc metal-organic framework isomers based on pyrazine tetracarboxylic acid and dipyridinylbenzene for adsorption and separation of CO2 and light hydrocarbons. Dalton Trans. 2020, 49, 1135–1142. https://doi.org/10.1039/c9dt04305e.Suche in Google Scholar
8. Huang, X., Qi, Y., Gu, Y., Gong, S., Shen, G., Li, Q., Li, J. Imidazole-directed fabrication of three polyoxovanadates-based copper frameworks as efficient catalysts for constructing of C–N bonds. Dalton Trans. 2020, 49, 10970–10976. https://doi.org/10.1039/d0dt02162h.Suche in Google Scholar
9. Dou, M. Y., Zhong, D. D., Huang, X. Q., Yang, G. Y. Imidazole-induced self-assembly of polyoxovanadate cluster organic framework for efficient Knoevenagel condensation under mild conditions. CrystEngComm 2020, 22, 4147–4153. https://doi.org/10.1039/d0ce00660b.Suche in Google Scholar
10. Chen, B., Huang, X., Wang, B., Lin, Z., Hu, J., Chi, Y., Hu, C. Three new imidazole-functionalized hexanuclear oxidovanadium clusters with exceptional catalytic oxidation properties for alcohols. Chem. Eur J. 2013, 19, 4408–4413. https://doi.org/10.1002/chem.201203854.Suche in Google Scholar
11. Lee, C. K., Ling, M. J., Lin, I. J. B. Organic-inorganic hybrids of imidazole complexes of palladium(II), copper(II) and zinc(II) crystals and liquid crystals. Dalton Trans. 2003, 24, 4731–4737. https://doi.org/10.1039/b308648h.Suche in Google Scholar
© 2020 Bingchuan Yang et al., published by De Gruyter, Berlin/Boston
This work is licensed under the Creative Commons Attribution 4.0 International License.
Artikel in diesem Heft
- Frontmatter
- New Crystal Structures
- The crystal structure of 4-hydroxybenzene-1,3-diaminium dichloride, C6H10Cl2N2O
- The crystal structure of 3-chloropropylammonium chloride, C3H9Cl2N
- The crystal structure of 1-chloro-2-(dimethylamino)ethane hydrochloride, C4H11Cl2N
- Crystal structure of N-(2-(trifluoromethyl)phenyl)hexanamide, C13H16F3NO
- Redetermination of the crystal structure of para-toluidine, C7H9N
- The crystal structure of bis(1,3-dihydroxy-2-methylpropan-2-aminium) carbonate, C9H24N2O7
- The crystal structure of 4-chloro-1-methylpiperidin-1-ium chloride, C6H13Cl2N
- Crystal structure of (Z)-3-(6-bromo-1H-indol-3-yl)-1,3-diphenylprop-2-en-1-one, C23H16BrNO
- The crystal structure of ethyl 2-amino-4-(3,5-difluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, C20H21F2NO4
- Crystal structure of 6,6'‐((1E,1'E)‐(propane‐1,3‐diylbis(azaneylylidene))bis(methaneylylidene))bis(3‐bromophenol), C34H32Br4N4O4
- The crystal structure of (E)-2-(2-((2-picolinoylhydrazono)methyl)phenoxy)acetic acid dihydrate, C15H17N3O6
- Crystal structure of (E)-4-bromo-N′-(3-chloro-2-hydroxybenzylidene)benzohydrazide, C14H10BrClN2O2
- Crystal structure of N,N′-bis(4-bromosalicylidene) ethylene-1,2-diaminopropan, C34H32Br4N4O4
- Crystal structure of 4-bromo-N′-[(3-bromo-2-hydroxyphenyl)methylidene]benzohydrazide methanol solvate, C15H14Br2N2O3
- The crystal structure of 1,2-bis(1H-benzo[d]imidazol-2-yl)ethane-1,2-diol — N-(2-aminophenyl)-3-(1H-benzo[d]imidazol-2-yl)-2,3-dihydroxypropanamide (1/1), C32H30N8O5
- The crystal structure of para-trifluoromethyl-aniline hemihydrate, C14H14F6N2O
- Redetermination of the crystal structure of 2-amino-2-methyl-propane-1,3-diole, C4H11NO2
- The crystal structure of methacholine chloride, C8H18ClNO2
- Crystal structure of 5,7,7-trimethyl-4,6,7,8-tetrahydrocyclopenta[g]isochromen-1(3H)-one, C15H18O2
- Crystal structure of poly[diammine-bis(μ4-4-hydroxypyridine-3-sulfonato-κ5N:O, O′:O′′:O′′)(μ2-pyrazinyl-κ2N:N′)tetrasilver(I)], C7H8Ag2N3O4S
- Crystal structure of ethyl (E)-5-(((3′,6′-bis(ethylamino)-3-oxospiro[isoindoline-1,9′-xanthen]-2-yl)imino)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate — ethanol (1/1), C38H45N5O5
- Crystal structure of 4-bromo-N′-[(3-chloro-2-hydroxyphenyl)methylidene]benzohydrazide, C14H7Br2N2O2
- Redetermination of the crystal structure of 3,3,3-triphenylpropanoic acid, C21H18O2 – Deposition of hydrogen atomic coordinates
- Structure redetermination of dextromethorphan hydrobromide monohydrate, C18H28BrNO2 – localization of hydrogen atoms
- Crystal structure of tris(azido-κ1N)-(N-(2-aminoethyl)-N-methyl-1,3-propanediamine-κ3N,N′,N′′)cobalt(III), C7H19CoN12
- Crystal structure of tetraaqua-bis(1H-indazole-6-carboxylate-κN)cadmium (II), C16H18CdN4O8
- Crystal structure of dichloride-bis(1-propylimidazole-κ1N)zinc(II), C12H20Cl2N4Zn
- Crystal structure of (E)-resveratrol 3-O-β-D-xylopyranoside, C19H22O8
- Crystal structure of 3,3′-(1,2-phenylene-bis(methylene))bis(1-vinyl- 1H-imidazol-3-ium) bis(hexafluoro phosphate)(V), C18H20F12N4P2
- Crystal structure of diaqua[bis(benzimidazol-2-yl-methyl)amine-κ3N,N′,N″]-phthalato-κ1O-nickel(II)-methanol (1/2), C26H31N5NiO8
- Crystal structure of 6,7-difluoro-1-methyl-3-(trifluoromethyl)quinoxalin-2(1H)-one, C10H5F5N2O
- Crystal structure of dichlorido-bis(1-hexyl-1H-benzotriazole-k1N)zinc(II), C24H34N6Cl2Zn
- The crystal structre of 2-(4-bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine, C16H12BBrN2
- Crystal structure of diethyl 3,9-bis(4-fluorophenyl)-6,12-diphenyl-3,9-diazapentacyclo[6.4.0.02,7.04,11]dodecane-1,5-dicarboxylate, C40H36F2N2O4
- Crystal structure of (E)-7-methoxy-2-((5-methoxypyridin-3-yl)methylene)-3,4- dihydronaphthalen-1(2H)-one, C18H17NO3
- Crystal structure of (E)-2-chloro-6-(((1,3-dihydroxy-2-(oxidomethyl)propan-2-yl)imino)methyl)phenolate-κ3N,O,O’)manganese(IV), C22H24Cl2MnN2O8
- The crystal structure of α-(meta-methoxyphenoxy)-ortho-tolylic acid, C15H14O4
- The crystal structure of N-(2-chloroethyl)-N,N-diethylammonium chloride, C6H15Cl2N
- The crystal structure of tris(2,3,4,6,7,8,9,10-octahydro-1H-pyrimido[1,2-a]azepin-5-ium) trihydrodecavanadate(V), C27H54N6O28V10
- Crystal structure of 1,3-bis(octyl)benzimidazolium perchlorate C23H39ClN2O4
- Crystal structure of tetrakis[(Z)-(2-(1-(furan-2-yl)-2-methylpropylidene)-1-phenylhydrazin-1-ido-κ2N,N′)] zirconium(IV), C56H60N8O4Zr
- The crystal structure of 2-(naphthalen-2-yloxy)-4-phenyl-6-(prop-2-yn-1-yloxy)-1,3,5-triazine, C22H15N3O2
- The crystal structure of trimethylsulfonium tris(trifluoromethylsulfonyl)methanide, C7H9F9O6S4
- Crystal structure of 4-bromo-N′-[3,5-dichloro-2-hydroxyphenyl)methylidene]benzohydrazide methanol solvate, C15H13BrCl2N2O3
- The crystal structure of 4-(4-bromophenyl)-2-(3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)thiazole, C24H16Br2FN3S
- The crystal structure of N-(adamantan-1-yl)-piperidine-1-carbothioamide, C16H26N2S
- The crystal structure of 1-phenyl-N-(4,5,6,7-tetrabromo-1,3-dioxoisoindolin-2-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide-dimethylformamide (1/1) C22H10Br4N4O3S
- The crystal structure of benzeneseleninic acid anhydride, C12H10O3Se2
- The crystal structure of diphenyalmine hydrochloride antimony trichloride co-crystallizate, C12H12Cl4NSb – Localization of hydrogen atoms
- The crystal structure of para-nitrobenzylbromide, C7H6BrNO2 – A second polymorph and correction of 3D coordinates
- Crystal structure of catena-poly[(5H-pyrrolo[3,2-b:4,5-b′]dipyridine-κ2N,N′)-(μ4-hexaoxidodivanadato)dizinc(II)],C10H9N3O6V2Zn
- Crystal structure of N,N′-(2-hydroxypropane-1,3-diyl)bis(pyridine-2-aldimine)-κ5N,N′,N′′,N′′′,O]-tris(nitrato-κ2O,O′) cerium(III), C15H16CeN7O10
- Synthesis and crystal structure of oktakis(dimethylsulphoxide-κ1O)gadolinium(III) [tetrabromido-μ2-bromido-μ2-sulfido-di-μ3-sulfido-μ4-sulfido-tetracopper(I)-tungsten(VI)], C16H48O8S12Br5Cu4GdW
- Crystal structure of {tris((1H-benzo[d]imidazol-2- yl)methyl)amine-κ4N,N′,N′′,N′′′}-(succinato-κ2O,O′)nickel(II) – methanol (1/4), C32H41N7NiO8
- Crystal structure of catena-poly[trans-tetraaqua(μ2-1,1′-(biphenyl-4,4′-diyl)bis(1H-imidazol)-k2N:N′)cobalt(II)] dinitrate – 1,1′-(biphenyl-4,4′-diyl)bis(1H-imidazol) – water (1/3/2), C72H68CoN18O12
- Crystal structure of bis(μ2-2-oxido-2-phenylacetate-κ3O:O,O′)-bis(1-isopropoxy-2-oxo-2-phenylethan-1-olato-κ2O,O′)-bis(propan-2-olato-κ1O)dititanium(IV), C44H52O14Ti2
- The crystal structure of 5-carboxy-2-(hydroxymethyl)-1H-imidazol-3-ium-4-carboxylate, C6H8N2O6
- The crystal structure of 2,6-dibromo-4-fluoroaniline, C6H4Br2FN
- The crystal structure of 4-chloro-N-(2-phenoxyphenyl)benzamide, C19H14ClNO2
- The crystal structure of 2-methyl-β-naphthothiazole, C12H9NS
Artikel in diesem Heft
- Frontmatter
- New Crystal Structures
- The crystal structure of 4-hydroxybenzene-1,3-diaminium dichloride, C6H10Cl2N2O
- The crystal structure of 3-chloropropylammonium chloride, C3H9Cl2N
- The crystal structure of 1-chloro-2-(dimethylamino)ethane hydrochloride, C4H11Cl2N
- Crystal structure of N-(2-(trifluoromethyl)phenyl)hexanamide, C13H16F3NO
- Redetermination of the crystal structure of para-toluidine, C7H9N
- The crystal structure of bis(1,3-dihydroxy-2-methylpropan-2-aminium) carbonate, C9H24N2O7
- The crystal structure of 4-chloro-1-methylpiperidin-1-ium chloride, C6H13Cl2N
- Crystal structure of (Z)-3-(6-bromo-1H-indol-3-yl)-1,3-diphenylprop-2-en-1-one, C23H16BrNO
- The crystal structure of ethyl 2-amino-4-(3,5-difluorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, C20H21F2NO4
- Crystal structure of 6,6'‐((1E,1'E)‐(propane‐1,3‐diylbis(azaneylylidene))bis(methaneylylidene))bis(3‐bromophenol), C34H32Br4N4O4
- The crystal structure of (E)-2-(2-((2-picolinoylhydrazono)methyl)phenoxy)acetic acid dihydrate, C15H17N3O6
- Crystal structure of (E)-4-bromo-N′-(3-chloro-2-hydroxybenzylidene)benzohydrazide, C14H10BrClN2O2
- Crystal structure of N,N′-bis(4-bromosalicylidene) ethylene-1,2-diaminopropan, C34H32Br4N4O4
- Crystal structure of 4-bromo-N′-[(3-bromo-2-hydroxyphenyl)methylidene]benzohydrazide methanol solvate, C15H14Br2N2O3
- The crystal structure of 1,2-bis(1H-benzo[d]imidazol-2-yl)ethane-1,2-diol — N-(2-aminophenyl)-3-(1H-benzo[d]imidazol-2-yl)-2,3-dihydroxypropanamide (1/1), C32H30N8O5
- The crystal structure of para-trifluoromethyl-aniline hemihydrate, C14H14F6N2O
- Redetermination of the crystal structure of 2-amino-2-methyl-propane-1,3-diole, C4H11NO2
- The crystal structure of methacholine chloride, C8H18ClNO2
- Crystal structure of 5,7,7-trimethyl-4,6,7,8-tetrahydrocyclopenta[g]isochromen-1(3H)-one, C15H18O2
- Crystal structure of poly[diammine-bis(μ4-4-hydroxypyridine-3-sulfonato-κ5N:O, O′:O′′:O′′)(μ2-pyrazinyl-κ2N:N′)tetrasilver(I)], C7H8Ag2N3O4S
- Crystal structure of ethyl (E)-5-(((3′,6′-bis(ethylamino)-3-oxospiro[isoindoline-1,9′-xanthen]-2-yl)imino)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate — ethanol (1/1), C38H45N5O5
- Crystal structure of 4-bromo-N′-[(3-chloro-2-hydroxyphenyl)methylidene]benzohydrazide, C14H7Br2N2O2
- Redetermination of the crystal structure of 3,3,3-triphenylpropanoic acid, C21H18O2 – Deposition of hydrogen atomic coordinates
- Structure redetermination of dextromethorphan hydrobromide monohydrate, C18H28BrNO2 – localization of hydrogen atoms
- Crystal structure of tris(azido-κ1N)-(N-(2-aminoethyl)-N-methyl-1,3-propanediamine-κ3N,N′,N′′)cobalt(III), C7H19CoN12
- Crystal structure of tetraaqua-bis(1H-indazole-6-carboxylate-κN)cadmium (II), C16H18CdN4O8
- Crystal structure of dichloride-bis(1-propylimidazole-κ1N)zinc(II), C12H20Cl2N4Zn
- Crystal structure of (E)-resveratrol 3-O-β-D-xylopyranoside, C19H22O8
- Crystal structure of 3,3′-(1,2-phenylene-bis(methylene))bis(1-vinyl- 1H-imidazol-3-ium) bis(hexafluoro phosphate)(V), C18H20F12N4P2
- Crystal structure of diaqua[bis(benzimidazol-2-yl-methyl)amine-κ3N,N′,N″]-phthalato-κ1O-nickel(II)-methanol (1/2), C26H31N5NiO8
- Crystal structure of 6,7-difluoro-1-methyl-3-(trifluoromethyl)quinoxalin-2(1H)-one, C10H5F5N2O
- Crystal structure of dichlorido-bis(1-hexyl-1H-benzotriazole-k1N)zinc(II), C24H34N6Cl2Zn
- The crystal structre of 2-(4-bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine, C16H12BBrN2
- Crystal structure of diethyl 3,9-bis(4-fluorophenyl)-6,12-diphenyl-3,9-diazapentacyclo[6.4.0.02,7.04,11]dodecane-1,5-dicarboxylate, C40H36F2N2O4
- Crystal structure of (E)-7-methoxy-2-((5-methoxypyridin-3-yl)methylene)-3,4- dihydronaphthalen-1(2H)-one, C18H17NO3
- Crystal structure of (E)-2-chloro-6-(((1,3-dihydroxy-2-(oxidomethyl)propan-2-yl)imino)methyl)phenolate-κ3N,O,O’)manganese(IV), C22H24Cl2MnN2O8
- The crystal structure of α-(meta-methoxyphenoxy)-ortho-tolylic acid, C15H14O4
- The crystal structure of N-(2-chloroethyl)-N,N-diethylammonium chloride, C6H15Cl2N
- The crystal structure of tris(2,3,4,6,7,8,9,10-octahydro-1H-pyrimido[1,2-a]azepin-5-ium) trihydrodecavanadate(V), C27H54N6O28V10
- Crystal structure of 1,3-bis(octyl)benzimidazolium perchlorate C23H39ClN2O4
- Crystal structure of tetrakis[(Z)-(2-(1-(furan-2-yl)-2-methylpropylidene)-1-phenylhydrazin-1-ido-κ2N,N′)] zirconium(IV), C56H60N8O4Zr
- The crystal structure of 2-(naphthalen-2-yloxy)-4-phenyl-6-(prop-2-yn-1-yloxy)-1,3,5-triazine, C22H15N3O2
- The crystal structure of trimethylsulfonium tris(trifluoromethylsulfonyl)methanide, C7H9F9O6S4
- Crystal structure of 4-bromo-N′-[3,5-dichloro-2-hydroxyphenyl)methylidene]benzohydrazide methanol solvate, C15H13BrCl2N2O3
- The crystal structure of 4-(4-bromophenyl)-2-(3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)thiazole, C24H16Br2FN3S
- The crystal structure of N-(adamantan-1-yl)-piperidine-1-carbothioamide, C16H26N2S
- The crystal structure of 1-phenyl-N-(4,5,6,7-tetrabromo-1,3-dioxoisoindolin-2-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide-dimethylformamide (1/1) C22H10Br4N4O3S
- The crystal structure of benzeneseleninic acid anhydride, C12H10O3Se2
- The crystal structure of diphenyalmine hydrochloride antimony trichloride co-crystallizate, C12H12Cl4NSb – Localization of hydrogen atoms
- The crystal structure of para-nitrobenzylbromide, C7H6BrNO2 – A second polymorph and correction of 3D coordinates
- Crystal structure of catena-poly[(5H-pyrrolo[3,2-b:4,5-b′]dipyridine-κ2N,N′)-(μ4-hexaoxidodivanadato)dizinc(II)],C10H9N3O6V2Zn
- Crystal structure of N,N′-(2-hydroxypropane-1,3-diyl)bis(pyridine-2-aldimine)-κ5N,N′,N′′,N′′′,O]-tris(nitrato-κ2O,O′) cerium(III), C15H16CeN7O10
- Synthesis and crystal structure of oktakis(dimethylsulphoxide-κ1O)gadolinium(III) [tetrabromido-μ2-bromido-μ2-sulfido-di-μ3-sulfido-μ4-sulfido-tetracopper(I)-tungsten(VI)], C16H48O8S12Br5Cu4GdW
- Crystal structure of {tris((1H-benzo[d]imidazol-2- yl)methyl)amine-κ4N,N′,N′′,N′′′}-(succinato-κ2O,O′)nickel(II) – methanol (1/4), C32H41N7NiO8
- Crystal structure of catena-poly[trans-tetraaqua(μ2-1,1′-(biphenyl-4,4′-diyl)bis(1H-imidazol)-k2N:N′)cobalt(II)] dinitrate – 1,1′-(biphenyl-4,4′-diyl)bis(1H-imidazol) – water (1/3/2), C72H68CoN18O12
- Crystal structure of bis(μ2-2-oxido-2-phenylacetate-κ3O:O,O′)-bis(1-isopropoxy-2-oxo-2-phenylethan-1-olato-κ2O,O′)-bis(propan-2-olato-κ1O)dititanium(IV), C44H52O14Ti2
- The crystal structure of 5-carboxy-2-(hydroxymethyl)-1H-imidazol-3-ium-4-carboxylate, C6H8N2O6
- The crystal structure of 2,6-dibromo-4-fluoroaniline, C6H4Br2FN
- The crystal structure of 4-chloro-N-(2-phenoxyphenyl)benzamide, C19H14ClNO2
- The crystal structure of 2-methyl-β-naphthothiazole, C12H9NS