Information card for entry 7002331

Structure parameters

• Formula: C30 H37 P
• Calculated formula: C30 H37 P
• SMILES: P1(c3c4c1ccc1c4c(cc3)CC1)c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Phosphorus peri-bridged acenaphthenes: efficient syntheses, characterisation and quaternization reactions
• Authors of publication: Wawrzyniak, Piotr; Slawin, Alexandra M. Z.; Fuller, Amy L.; Woollins, J. Derek; Kilian, Petr
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 38
• Pages of publication: 7883 - 7884
• a: 5.9256 ± 0.0006 Å
• b: 10.4535 ± 0.001 Å
• c: 20.302 ± 0.002 Å
• α: 78.711 ± 0.004°
• β: 87.112 ± 0.004°
• γ: 85.654 ± 0.004°
• Cell volume: 1228.9 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0781
• Residual factor for significantly intense reflections: 0.0739
• Weighted residual factors for significantly intense reflections: 0.1832
• Weighted residual factors for all reflections included in the refinement: 0.1869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No