Information card for entry 7010098

Structure parameters

• Formula: C49 H39 Cl N3 O3 P2 Rh
• Calculated formula: C49 H39 Cl N3 O3 P2 Rh
• SMILES: [Rh]12(Cl)([P](c3ccccc3)(c3ccccc3)c3ccccc3)([P](c3ccccc3)(c3ccccc3)c3ccccc3)Oc3ccc(cc3[N]1=Nc1ccc(N(=O)=O)cc21)C
• Title of publication: Synthesis, structure and redox properties of some 2-(arylazo)phenolate complexes of rhodium(III) †
• Authors of publication: Dutta, Swati; Peng, Shie-Ming; Bhattacharya, Samaresh
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 24
• Pages of publication: 4623
• a: 11.9111 ± 0.0002 Å
• b: 16.9049 ± 0.0003 Å
• c: 21.4067 ± 0.0003 Å
• α: 90°
• β: 96.744 ± 0.001°
• γ: 90°
• Cell volume: 4280.54 ± 0.12 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• 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: 0.0636
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for all reflections: 0.0982
• Weighted residual factors for significantly intense reflections: 0.0823
• Goodness-of-fit parameter for all reflections: 1.044
• Goodness-of-fit parameter for significantly intense reflections: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No