Information card for entry 7105637

Structure parameters

• Formula: C6 H18 Cl6 Ga N2 P5 Si3
• Calculated formula: C6 H18 Cl6 Ga N2 P5 Si3
• SMILES: C[Si](C)(C)N1P2(=[N+]([Si](C)(C)C)[Si]1(Cl)Cl)P1P3P2P13.Cl[Ga](Cl)(Cl)[Cl-]
• Title of publication: Zwitterionic and cationic P₅-Clusters from four membered phosphorus nitrogen metal heterocycles
• Authors of publication: J.Weigand; M.Holthausen; C.Richter; A.Hepp
• Journal of publication: Chem.Commun.
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 37
• Pages of publication: 6921 - 6923
• a: 9.3085 ± 0.0006 Å
• b: 9.8158 ± 0.0007 Å
• c: 14.7125 ± 0.001 Å
• α: 87.568 ± 0.001°
• β: 80.732 ± 0.001°
• γ: 71.578 ± 0.001°
• Cell volume: 1258.7 ± 0.15 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0305
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No