Information card for entry 7012851

Structure parameters

• Formula: C7 H20 Cl O2 P Si2
• Calculated formula: C7 H20 Cl O2 P Si2
• SMILES: P(=O)(Cl)(O)C([Si](C)(C)C)[Si](C)(C)C
• Title of publication: An unconventional route to [(Me3Si)2HCPCl2W(CO)5] and its conversion to the structurally characterized P-chalcogenides (Me3Si)2HCP(X)Cl2 [X = S, Se]
• Authors of publication: Khan, Arif Ali; Wismach, Cathleen; Jones, Peter G.; Streubel, Rainer
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 2483
• a: 6.7903 ± 0.0006 Å
• b: 8.7696 ± 0.0008 Å
• c: 12.5541 ± 0.001 Å
• α: 75.307 ± 0.003°
• β: 77.234 ± 0.003°
• γ: 72.823 ± 0.003°
• Cell volume: 682.19 ± 0.1 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: 0.0374
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No