Information card for entry 7027041

Structure parameters

• Formula: C24 H41 F3 O3 P Rh S
• Calculated formula: C24 H41 F3 O3 P Rh S
• SMILES: [Rh]123456([P](C(C)C)(C(C)C)C(C)C)([CH]7=[CH]1CCCCCC7)[cH]1[cH]6[cH]5[cH]4[cH]3[cH]21.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Preparation, molecular structure and reactivity of mono- and di-nuclear sulfonato rhodium(I) complexes
• Authors of publication: Werner, Helmut; Bosch, Marco; Schneider, Michael E.; Hahn, Christine; Kukla, Frank; Manger, Matthias; Windmüller, Bettina; Weberndörfer, Birgit; Laubender, Matthias
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 21
• Pages of publication: 3549
• a: 14.042 ± 0.004 Å
• b: 15.347 ± 0.004 Å
• c: 15.532 ± 0.002 Å
• α: 63.12 ± 0.02°
• β: 73.03 ± 0.02°
• γ: 70.98 ± 0.02°
• Cell volume: 2780.8 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.035
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for all reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.0704
• Goodness-of-fit parameter for all reflections: 1.054
• Goodness-of-fit parameter for significantly intense reflections: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No