Information card for entry 2015410

Structure parameters

• Common name: o-phenylenebis(diphenylphosphine)
• Chemical name: 1,2-bis(diphenylphosphino)benzene
• Formula: C30 H24 P2
• Calculated formula: C30 H24 P2
• SMILES: P(c1c(P(c2ccccc2)c2ccccc2)cccc1)(c1ccccc1)c1ccccc1
• Title of publication: 1,2-Bis(diphenylphosphino)benzene and two related mono-methiodides, [<i>o</i>-C~6~H~4~(P<i>R</i>~2~)(P<i>R</i>~2~Me)]I (<i>R</i> = Ph or Me)
• Authors of publication: Levason, William; Reid, Gillian; Webster, Michael
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: o438 - o440
• a: 8.193 ± 0.0015 Å
• b: 12.442 ± 0.002 Å
• c: 12.584 ± 0.003 Å
• α: 109.846 ± 0.005°
• β: 99.918 ± 0.005°
• γ: 98.33 ± 0.015°
• Cell volume: 1159.6 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.1566
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1017
• Weighted residual factors for all reflections included in the refinement: 0.1319
• Goodness-of-fit parameter for all reflections included in the refinement: 0.925
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No