Information card for entry 8105630

Structure parameters

• Formula: C24 H26 Cd Cl2 N10
• Calculated formula: C24 H26 Cd Cl2 N10
• SMILES: c1cccc2c1n(Cn1c(C)[n](c(c1)C)[Cd](Cl)(Cl)[n]1c(C)n(Cn3c4ccccc4nn3)cc1C)nn2
• Title of publication: Crystal structure of dichlorido bis[1-((2,4-dimethyl-1H-imidazol-1-yl)methyl)-1H-benzo[d][1,2,3]triazole-κN]cadmium(II), Cd(C12H13N5)2Cl2
• Authors of publication: Wang, Xia; Ling, Ning; Yang, Jing; Song, Ning
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 2
• Pages of publication: 321 - 323
• a: 9.3081 ± 0.0002 Å
• b: 11.7526 ± 0.0003 Å
• c: 24.9876 ± 0.0006 Å
• α: 90°
• β: 94.184 ± 0.002°
• γ: 90°
• Cell volume: 2726.22 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0524
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No