Information card for entry 7118028

Structure parameters

• Formula: C40 H72 Bi2 N8 P4
• Calculated formula: C40 H72 Bi2 N8 P4
• SMILES: [Bi]1234[Bi]([N]5=C(P=C(N15)C(C)(C)C)C(C)(C)C)(N1[N]2=C(P=C1C(C)(C)C)C(C)(C)C)([N]1=C(P=C(N31)C(C)(C)C)C(C)(C)C)N1[N]4=C(P=C1C(C)(C)C)C(C)(C)C
• Title of publication: Paddlewheel 1,2,4-diazaphospholide dibismuthanes with very short bismuth-bismuth single bonds
• Authors of publication: Minggang Zhao; Lixia Wang; Pangpang Li; Xiang Zhang; Ying Yang; Wenjun Zheng
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 16184
• a: 23.3993 ± 0.0014 Å
• b: 10.7452 ± 0.0005 Å
• c: 21.7187 ± 0.0017 Å
• α: 90°
• β: 114.212 ± 0.008°
• γ: 90°
• Cell volume: 4980.4 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0956
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.1042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No