Information card for entry 7132360

Structure parameters

• Formula: C61 H68 O3 P Sb
• Calculated formula: C61 H68 O3 P Sb
• SMILES: [Sb]1(Oc2c(O1)cc(cc2C(C)(C)C)C(C)(C)C)(c1ccccc1)(c1ccccc1)c1c2Oc3c(cc(C(C)(C)C)cc3P(c3ccccc3)c3ccccc3)C(c2cc(c1)C(C)(C)C)(C)C
• Title of publication: Pnictogen bonding at the service of gold catalysis: the case of a phosphinostiborane gold complex.
• Authors of publication: Zhou, Benyu; Bedajna, Shantabh; Gabbaï, François P
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 60
• Journal issue: 2
• Pages of publication: 192 - 195
• a: 10.577 ± 0.0006 Å
• b: 15.3832 ± 0.0009 Å
• c: 16.6017 ± 0.0009 Å
• α: 91.68 ± 0.002°
• β: 101.133 ± 0.002°
• γ: 96.861 ± 0.003°
• Cell volume: 2627.6 ± 0.3 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 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: 0.0356
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0611
• Weighted residual factors for all reflections included in the refinement: 0.0655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No