Information card for entry 7708439

Structure parameters

• Formula: C60 H72 Fe I2 N4 O P2 Sn
• Calculated formula: C60 H72 Fe I2 N4 O P2 Sn
• Title of publication: Application of Ferrocene-Bridged N-Heterocyclic Carbene Stabilised Bis-Phosphinidenes in Sn(II) Complexation
• Authors of publication: Baierl, Ramona; Kostenko, Arseni; Hanusch, Franziska; Inoue, Shigeyoshi
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 13.8207 ± 0.0004 Å
• b: 13.9298 ± 0.0004 Å
• c: 34.6173 ± 0.001 Å
• α: 90°
• β: 93.984 ± 0.002°
• γ: 90°
• Cell volume: 6648.4 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• 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: 0.0545
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.114
• Weighted residual factors for all reflections included in the refinement: 0.1251
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No