Information card for entry 8107576

Structure parameters

• Formula: C26 H30 Cd2 I4 N10
• Calculated formula: C26 H30 Cd2 I4 N10
• Title of publication: Crystal structure of cyclo[tetraiodido-bis{μ2-1-[(benzotriazol-1-yl)methyl]-1-H-1,3-(2-isopropyl-imidazol)-k 2N:N}dicadmiun(II)], C26H30N10Cd2I4
• Authors of publication: Yang, Hai-Yan; Wang, Hong-Fang; Li, Hui; Li, Ying-Hua; Zhao, Yao-Min
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 5
• Pages of publication: 835 - 836
• a: 8.1164 ± 0.001 Å
• b: 15.9401 ± 0.0018 Å
• c: 13.5531 ± 0.0017 Å
• α: 90°
• β: 96.067 ± 0.004°
• γ: 90°
• Cell volume: 1743.6 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No