Information card for entry 4069263

Structure parameters

• Formula: C52 H62 O5 P2 Sb2
• Calculated formula: C52 H49 O5 P2 Sb2
• SMILES: [Sb]12([O]=P3(O[Sb]([O]=P4(O1)C(C)(C)C(C)C4(C)C)(O2)(c1ccccc1)(c1ccccc1)c1ccccc1)C(C)(C)C(C)C3(C)C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: A Nonanuclear Organostiboxane Cage
• Authors of publication: Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 8
• Pages of publication: 2637
• a: 10.8548 ± 0.0017 Å
• b: 12.1442 ± 0.0019 Å
• c: 19.956 ± 0.003 Å
• α: 95.08 ± 0.003°
• β: 99.305 ± 0.003°
• γ: 103.353 ± 0.002°
• Cell volume: 2504.1 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No