Information card for entry 4334674

Structure parameters

• Formula: C13 H26 Cl4 Ga N2 O P Si2
• Calculated formula: C13 H26 Cl4 Ga N2 O P Si2
• SMILES: [P+]1(N=C=O)(N([Si](C)(C)C)[Si](C)(C)C)[C@@H]2C=C[C@H]1CC2.[Ga]([Cl-])(Cl)(Cl)Cl
• Title of publication: On the Synthesis and Reactivity of Highly Labile Pseudohalogen Phosphenium Ions
• Authors of publication: Christian Hering; Axel Schulz; Alexander Villinger
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 5214 - 5225
• a: 14.604 ± 0.0003 Å
• b: 10.2486 ± 0.0002 Å
• c: 15.9942 ± 0.0003 Å
• α: 90°
• β: 105.269 ± 0.001°
• γ: 90°
• Cell volume: 2309.36 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0795
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No