Information card for entry 8105891

Structure parameters

• Formula: C22 H22 Cd I2 N10
• Calculated formula: C22 H22 Cd I2 N10
• Title of publication: Crystal structure of Bis{1-[(benzotriazol-1-yl)methyl]-1-H-1,3-(2-methyl-imidazol)}diiodidocadmium(II), [Cd(C11H11N5)2I2], C22H22N10I2Cd
• Authors of publication: Yang, Hai-Yan; He, Fang; Zhao, Yao-Min; Li, Hui; Wang, Hong-Fang; Li, Ying-Hua
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 5
• Pages of publication: 919 - 921
• a: 10.5476 ± 0.0008 Å
• b: 11.1759 ± 0.0009 Å
• c: 12.7735 ± 0.001 Å
• α: 103.372 ± 0.007°
• β: 105.811 ± 0.007°
• γ: 100.27 ± 0.006°
• Cell volume: 1361.8 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.0661
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No