Information card for entry 2201185

Structure parameters

• Chemical name: (2-Chlorophenyl)diphenylphosphine
• Formula: C18 H14 Cl P
• Calculated formula: C18 H14 Cl P
• SMILES: Clc1c(P(c2ccccc2)c2ccccc2)cccc1
• Title of publication: (2-Chlorophenyl)diphenylphosphine
• Authors of publication: Williams, Michael L.; Noack, Cassandra L.; Saverin, Rodney J.; Healy, Peter C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 4
• Pages of publication: o419 - o421
• a: 10.646 ± 0.008 Å
• b: 10.702 ± 0.006 Å
• c: 8.53 ± 0.006 Å
• α: 105.53 ± 0.06°
• β: 99.88 ± 0.06°
• γ: 119.27 ± 0.04°
• Cell volume: 762.1 ± 1.1 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.07
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes