Information card for entry 7013255

Structure parameters

• Formula: C45 H54 Al2 Cl N2 P2 Si2
• Calculated formula: C45 H55 Al2 Cl N2 P2 Si2
• SMILES: [Al]1([N](=P(c2c1cccc2)(c1ccccc1)c1ccccc1)[Si](C)(C)C)(C)C.[Al]1([N](=P(c2c1cccc2)(c1ccccc1)c1ccccc1)[Si](C)(C)C)(Cl)C
• Title of publication: Metallated triphenylphosphinimine complexes
• Authors of publication: Wei, Pingrong; Chan, Katie T. K.; Stephan, Douglas W.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 19
• Pages of publication: 3804
• a: 20.492 ± 0.012 Å
• b: 9.113 ± 0.005 Å
• c: 26.214 ± 0.016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4895 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1045
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.159
• Goodness-of-fit parameter for all reflections included in the refinement: 0.818
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No