Information card for entry 4314022

Structure parameters

• Formula: C36 H54 N2 P V
• Calculated formula: C36 H54 N2 P V
• SMILES: [V](N=P(C(C)(C)C)(C(C)(C)C)C(C)(C)C)(=Nc1c(cccc1C(C)C)C(C)C)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis and Characterization of Vanadium(V)-Phosphinimide Complexes
• Authors of publication: Sarah B. Hawkeswood; Douglas W. Stephan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5429 - 5433
• a: 12.22 ± 0.003 Å
• b: 13.049 ± 0.006 Å
• c: 13.108 ± 0.005 Å
• α: 88.73 ± 0.03°
• β: 73.3 ± 0.03°
• γ: 63.48 ± 0.03°
• Cell volume: 1777.6 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1158
• Residual factor for significantly intense reflections: 0.0797
• Weighted residual factors for significantly intense reflections: 0.1722
• Weighted residual factors for all reflections included in the refinement: 0.1995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No