Information card for entry 4339557

Structure parameters

• Common name: compound 1
• Formula: C18 H39 Bi Cu I5 N2
• Calculated formula: C18 H39 Bi Cu I5 N2
• Title of publication: A series of new copper iodobismuthates: structural relationships, optical band gaps affected by dimensionality, and distinct thermal stabilities.
• Authors of publication: Chai, Wen-Xiang; Wu, Li-Ming; Li, Jun-Qian; Chen, Ling
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 21
• Pages of publication: 8698 - 8704
• a: 12.035 ± 0.005 Å
• b: 12.357 ± 0.005 Å
• c: 13.231 ± 0.005 Å
• α: 109.667 ± 0.004°
• β: 91.205 ± 0.001°
• γ: 117.254 ± 0.002°
• Cell volume: 1610.7 ± 1.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.0977
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No