Information card for entry 7010852

Structure parameters

• Formula: C28 H32 Cl4 N2 P Rh
• Calculated formula: C28 H32 Cl4 N2 P Rh
• SMILES: [Rh]12345(Cl)([P](c6ccccc6)(c6ccccc6)Nc6[n]1cccc6)[c]1([c]5([c]4([c]3([c]21C)C)C)C)C.[Cl-].C(Cl)Cl
• Title of publication: Synthesis and structure of novel rhodium complexes of multi-functionalised amine-phosphine ligands
• Authors of publication: Clarke, Matthew L.; Slawin, Alexandra M. Z.; Wheatley, Matthew V.; Woollins, J. Derek
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 23
• Pages of publication: 3421
• a: 8.5863 ± 0.0004 Å
• b: 10.3041 ± 0.0005 Å
• c: 18.7795 ± 0.0009 Å
• α: 97.606 ± 0.001°
• β: 94.21 ± 0.001°
• γ: 112.404 ± 0.001°
• Cell volume: 1508.6 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0619
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for all reflections: 0.1288
• Weighted residual factors for significantly intense reflections: 0.1102
• Goodness-of-fit parameter for all reflections: 0.983
• Goodness-of-fit parameter for significantly intense reflections: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No