Information card for entry 2202653

Structure parameters

• Common name: 1,2-Bis(ditolylphosphino)ethane
• Chemical name: 1,2-Bis(ditolylphosphino)ethane
• Formula: C30 H32 P2
• Calculated formula: C30 H32 P2
• SMILES: Cc1ccc(cc1)P(c1ccc(cc1)C)CCP(c1ccc(cc1)C)c1ccc(cc1)C
• Title of publication: 1,2-Bis(ditolylphosphino)ethane
• Authors of publication: Zeller, Matthias; Evelyn Lazich; Timothy R. Wagner; Hunter, Allen D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: o1721 - o1722
• a: 9.5469 ± 0.0005 Å
• b: 11.8565 ± 0.0006 Å
• c: 14.3645 ± 0.0007 Å
• α: 90°
• β: 128.731 ± 0.001°
• γ: 90°
• Cell volume: 1268.4 ± 0.11 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1209
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes