Information card for entry 7021858

Structure parameters

• Chemical name: methanediylbis(dimethylphosphane) dioxide
• Formula: C5 H14 O2 P2
• Calculated formula: C5 H14 O2 P2
• SMILES: P(=O)(C)(C)CP(=O)(C)C
• Title of publication: Hypervalent neutral O-donor ligand complexes of silicon tetrafluoride, comparisons with other group 14 tetrafluorides and a search for soft donor ligand complexes.
• Authors of publication: George, Kathryn; Hector, Andrew L.; Levason, William; Reid, Gillian; Sanderson, George; Webster, Michael; Zhang, Wenjian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 7
• Pages of publication: 1584 - 1593
• a: 31.36 ± 0.006 Å
• b: 5.7109 ± 0.0015 Å
• c: 9.488 ± 0.004 Å
• α: 90°
• β: 95.231 ± 0.015°
• γ: 90°
• Cell volume: 1692.2 ± 0.9 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1057
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for significantly intense reflections: 0.1229
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No