Information card for entry 7034187

Structure parameters

• Formula: C59 H65 Cl N3 P Rh
• Calculated formula: C59 H65 Cl N3 P Rh
• Title of publication: Pyridine versus acetonitrile coordination in rhodium-N-heterocyclic carbene square-planar complexes.
• Authors of publication: Palacios, Laura; Di Giuseppe, Andrea; Castarlenas, Ricardo; Lahoz, Fernando J.; Pérez-Torrente, Jesús J; Oro, Luis A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 12
• Pages of publication: 5777 - 5789
• a: 11.6031 ± 0.0008 Å
• b: 12.7696 ± 0.0009 Å
• c: 17.4596 ± 0.0012 Å
• α: 79.885 ± 0.0008°
• β: 78.2321 ± 0.0008°
• γ: 80.9152 ± 0.0008°
• Cell volume: 2473.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0405
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No