Information card for entry 4334658

Structure parameters

• Formula: C4 H11 Cl2 P
• Calculated formula: C4 H11 Cl2 P
• SMILES: C[P+](C)(C)CCl.[Cl-]
• Title of publication: Phosphine and Diphosphine Complexes of Silicon(IV) Halides
• Authors of publication: William Levason; David Pugh; Gillian Reid
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 5185 - 5193
• a: 12 ± 0.006 Å
• b: 10.204 ± 0.005 Å
• c: 12.936 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1584 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1841
• Weighted residual factors for all reflections included in the refinement: 0.1923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No