Information card for entry 4086095

Structure parameters

• Formula: C28 H43 N2 O2 P Si W2
• Calculated formula: C28 H43 N2 O2 P Si W2
• SMILES: [W]12345([WH]6789([P]1(C1CCCCC1)C1CCCCC1)(=N/N=C/[Si](C)(C)C)[cH]1[cH]6[cH]7[cH]8[cH]91)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51
• Title of publication: Thermally Stable Diazoalkane Derivatives of the Unsaturated Ditungsten Hydride [W2Cp2(H)(μ-PCy2)(CO)2]
• Authors of publication: Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Huergo, Estefanía; Ruiz, Miguel A.; Vega, M. Fernanda
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 3833
• a: 10.2516 ± 0.0011 Å
• b: 10.2689 ± 0.0011 Å
• c: 14.7077 ± 0.0015 Å
• α: 84.615 ± 0.005°
• β: 85.915 ± 0.004°
• γ: 81.378 ± 0.004°
• Cell volume: 1521.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No