Information card for entry 4121726

Structure parameters

• Formula: C36 H71 Sb Si3
• Calculated formula: C36 H71 Sb Si3
• SMILES: C[Si](C(C)(C)C)(C(C)(C)C)[Si](=[Sb]c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)[Si](C)(C(C)(C)C)C(C)(C)C
• Title of publication: Stibasilene sb═si and its lighter homologues: a comparative study.
• Authors of publication: Lee, Vladimir Ya; Aoki, Shinji; Kawai, Manami; Meguro, Takahiko; Sekiguchi, Akira
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 17
• Pages of publication: 6243 - 6246
• a: 12.0632 ± 0.0013 Å
• b: 17.6672 ± 0.0019 Å
• c: 19.301 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4113.5 ± 0.8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No