Information card for entry 8102330

Structure parameters

• Formula: C39 H30 Cd2 N10 O8
• Calculated formula: C39 H30 Cd2 N10 O8
• Title of publication: Crystal structure of catena-poly[[bi(quinoxaline-2,3-diamine)-benzimidazole)trinuclear cadmium(II)]-m- benzene-1,3-dicarboxylato], {[Cd2(C8H8N4)2(C8H4O4)2]0.5 [Cd(C8H8N4)(C7H6N2)(C8H4O4)]}n
• Authors of publication: Jia-Jun Wang; Yun-Cheng Cui; Li-Hui Liu; Yan-Ju Huang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2008
• Journal volume: 223
• Journal issue: 4
• Pages of publication: 429
• a: 10.2834 ± 0.0008 Å
• b: 10.8709 ± 0.0008 Å
• c: 17.6139 ± 0.0013 Å
• α: 78.68 ± 0.001°
• β: 88.197 ± 0.001°
• γ: 67.862 ± 0.001°
• Cell volume: 1786.5 ± 0.2 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 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: 0.0478
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1168
• Weighted residual factors for all reflections included in the refinement: 0.1207
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No