Information card for entry 7112416

Structure parameters

• Formula: C37 H59 B2 K N4 P2
• Calculated formula: C37 H59 B2 K N4 P2
• Title of publication: Formation of a Ph2PCH(BH3)P(BH3)Ph2 ligand via formal 1,2-borane migration.
• Authors of publication: Langer, Jens; Pálfi, Villö K; Görls, Helmar; Reiher, Markus; Westerhausen, Matthias
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2013
• Journal volume: 49
• Journal issue: 11
• Pages of publication: 1121 - 1123
• a: 10.1261 ± 0.0002 Å
• b: 11.4604 ± 0.0004 Å
• c: 18.7902 ± 0.0008 Å
• α: 87.101 ± 0.002°
• β: 89.417 ± 0.002°
• γ: 70.312 ± 0.002°
• Cell volume: 2050.43 ± 0.12 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1039
• Residual factor for significantly intense reflections: 0.0836
• Weighted residual factors for significantly intense reflections: 0.164
• Weighted residual factors for all reflections included in the refinement: 0.1762
• Goodness-of-fit parameter for all reflections included in the refinement: 1.178
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7108815
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No