Information card for entry 7710561

Structure parameters

• Formula: C32 H41 Bi N2 O2 S2
• Calculated formula: C32 H41 Bi N2 O2 S2
• Title of publication: Organopnictogen(III) bis(arylthiolates) containing NCN-aryl pincer ligands: from synthesis and characterization to reactivity
• Authors of publication: Duneș, Gabriel; Soran, Albert; Silvestru, Cristian
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.4719 ± 0.0004 Å
• b: 19.9683 ± 0.0008 Å
• c: 15.1511 ± 0.0005 Å
• α: 90°
• β: 106.109 ± 0.001°
• γ: 90°
• Cell volume: 3043.8 ± 0.2 ų
• Cell temperature: 104 ± 2 K
• Ambient diffraction temperature: 104 ± 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 all reflections: 0.0238
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0326
• Weighted residual factors for all reflections included in the refinement: 0.0339
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No