Information card for entry 4114478

Structure parameters

• Formula: C28 H32 N4 P4
• Calculated formula: C28 H32 N4 P4
• SMILES: C[P@@]1(=N[P@](C)(=N[P@](C)(=N[P@](C)(=N1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Isolation and Characterization of Nongeminal Cyclic Methylphenylphosphazene Tetramers
• Authors of publication: June-Ho Jung; Julia C. Pomeroy; Hongming Zhang; Patty Wisian-Neilson
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 15537 - 15542
• a: 20.779 ± 0.001 Å
• b: 8.2761 ± 0.0005 Å
• c: 16.4341 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2826.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No