Information card for entry 4077195

Structure parameters

• Chemical name: Hexamethylbenzene Nitrosonium Hexafluorantimonate molecular complex 1:1
• Formula: C12 H18 F6 N O Sb
• Calculated formula: C12 H18 F6 N O Sb
• Title of publication: Electron Redistribution of Aromatic Ligands in (Arene)Cr(CO)3Complexes. Structural (Bond-Length) Changes as Quantitative Measures
• Authors of publication: Le Maguères, P.; Lindeman, S. V.; Kochi, J. K.
• Journal of publication: Organometallics
• Year of publication: 2001
• Journal volume: 20
• Journal issue: 1
• Pages of publication: 115
• a: 12.9243 ± 0.0003 Å
• b: 17.9474 ± 0.0004 Å
• c: 13.3904 ± 0.0004 Å
• α: 90°
• β: 100.09 ± 0.001°
• γ: 90°
• Cell volume: 3057.97 ± 0.13 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• 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: 0.0434
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for all reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.0608
• Goodness-of-fit parameter for all reflections: 1.061
• Goodness-of-fit parameter for significantly intense reflections: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No