Information card for entry 4079910

Structure parameters

• Formula: C24 H29 Bi N2 S2
• Calculated formula: C24 H29 Bi N2 S2
• SMILES: [Bi]12(Sc3ccccc3)(Sc3ccccc3)[N](C)(Cc3c1c(C[N]2(C)C)ccc3)C
• Title of publication: Oxidative Addition of Diphenyldichalcogenides PhEEPh (E = S, Se, Te) to Low-Valent CN- and NCN-Chelated Organoantimony and Organobismuth Compounds
• Authors of publication: Šimon, Petr; Jambor, Roman; Růžička, Aleš; Dostál, Libor
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 1
• Pages of publication: 239
• a: 10.327 ± 0.0007 Å
• b: 12.3949 ± 0.001 Å
• c: 18.608 ± 0.0009 Å
• α: 90°
• β: 92.454 ± 0.006°
• γ: 90°
• Cell volume: 2379.7 ± 0.3 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.049
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0513
• Weighted residual factors for all reflections included in the refinement: 0.0576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No