Information card for entry 4088403

Structure parameters

• Chemical name: (Z)-N-(1-(((E)-2,2-dimethyl-1-(phenylimino)propyl)(phenyl)phosphino)- 2,2-dimethylpropylidene)-2,4,6-trimethylaniline
• Formula: C31 H39 N2 P
• Calculated formula: C31 H39 N2 P
• SMILES: P(/C(=N/c1ccccc1)C(C)(C)C)(C(=N\c1c(cc(cc1C)C)C)/C(C)(C)C)c1ccccc1
• Title of publication: Bis(imino)phosphanes: Synthesis and Coordination Chemistry
• Authors of publication: van Dijk, Tom; Rong, Mark K.; Borger, Jaap E.; Nieger, Martin; Slootweg, J. Chris; Lammertsma, Koop
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 5
• Pages of publication: 827
• a: 14.081 ± 0.001 Å
• b: 11.9795 ± 0.0011 Å
• c: 15.955 ± 0.0014 Å
• α: 90°
• β: 90.047 ± 0.007°
• γ: 90°
• Cell volume: 2691.3 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• 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: 0.0498
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No