Information card for entry 7104948

Structure parameters

• Formula: C30 H29 Bi N O3 P
• Calculated formula: C30 H29 Bi N O3 P
• SMILES: [Bi]12(OP3(=O)Oc4c(c5c3cccc5)cccc4)[N](Cc3c1cccc3)(Cc1ccccc21)C(C)(C)C
• Title of publication: A unique Bi-Bi bond forming reaction using organobismuth oxides and phosphorus compounds bearing a P(=O)H group.
• Authors of publication: Shimada, Shigeru; Maruyama, Junpei; Choe, Yoong-Kee; Yamashita, Takashi
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal issue: 41
• Pages of publication: 6168 - 6170
• a: 11.8574 ± 0.0005 Å
• b: 12.944 ± 0.0005 Å
• c: 17.2181 ± 0.0007 Å
• α: 90°
• β: 104.122 ± 0.001°
• γ: 90°
• Cell volume: 2562.81 ± 0.18 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for all reflections included in the refinement: 0.0488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No