Information card for entry 7012084

Structure parameters

• Common name: [MesNPPh2CH2PPh2NPh].1/2(H2O)
• Formula: C40 H39 N2 O0.5 P2
• Calculated formula: C40 H39 N2 O0.5 P2
• Title of publication: Synthesis of C2 and Cs symmetric zinc complexes supported by bis(phosphinimino)methyl ligands and their use in ring opening polymerisation catalysis
• Authors of publication: Hill, Michael S.; Hitchcock, Peter B.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 24
• Pages of publication: 4694
• a: 26.6838 ± 0.0006 Å
• b: 53.8252 ± 0.0014 Å
• c: 9.4022 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13504 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0581
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No