Information card for entry 7009496

Structure parameters

• Formula: C89 H91 Bi4 O0.5 P Se13
• Calculated formula: C89 Bi4 O0.5 P Se13
• Title of publication: Polynuclear bismuth selenolates: rings en route to clusters
• Authors of publication: DeGroot, Marty W.; Corrigan, John F.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 8
• Pages of publication: 1235
• a: 13.9032 ± 0.0007 Å
• b: 23.4916 ± 0.0013 Å
• c: 30.3394 ± 0.0011 Å
• α: 79.858 ± 0.003°
• β: 83.279 ± 0.003°
• γ: 78.716 ± 0.002°
• Cell volume: 9530.6 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1531
• Residual factor for significantly intense reflections: 0.0799
• Weighted residual factors for significantly intense reflections: 0.1907
• Weighted residual factors for all reflections included in the refinement: 0.2208
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No