Information card for entry 7013025

Structure parameters

• Formula: C31 H24 N2 P2
• Calculated formula: C31 H24 N2 P2
• SMILES: P(P(c1ccccc1)c1ccccc1)(=Nc1ccc(cc1)C#N)(c1ccccc1)c1ccccc1
• Title of publication: Influence of the functional group on the synthesis of aminophosphines, diphosphinoamines and iminobiphosphines
• Authors of publication: Fei, Zhaofu; Scopelliti, Rosario; Dyson, Paul J.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 13
• Pages of publication: 2772
• a: 15.778 ± 0.003 Å
• b: 11.6783 ± 0.0016 Å
• c: 15.07 ± 0.002 Å
• α: 90°
• β: 112.375 ± 0.015°
• γ: 90°
• Cell volume: 2567.7 ± 0.7 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1643
• Weighted residual factors for all reflections included in the refinement: 0.1787
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No