Information card for entry 7001281

Structure parameters

• Chemical name: (η^4^-cycloocta-1,5-diene)((S)-N-phenylglycinato-κN,O)rhodium(I)
• Formula: C16 H20 N O2 Rh
• Calculated formula: C16 H20 N O2 Rh
• SMILES: [Rh]1234(OC(=O)C[NH]1c1ccccc1)[CH]1=[CH]2CC[CH]3=[CH]4CC1
• Title of publication: Polymorphs, enantiomorphs, chirality and helicity in [Rh{N,O}(η4-cod)] complexes with {N,O} = salicylaldiminato Schiff base or aminocarboxylato ligands
• Authors of publication: Janiak, Christoph; Chamayou, Anne-Christine; Royhan Uddin, A. K. M.; Uddin, Mohammad; Hagen, Karl S.; Enamullah, Mohammed
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 19
• Pages of publication: 3698 - 3709
• a: 9.5338 ± 0.0006 Å
• b: 9.5338 ± 0.0006 Å
• c: 16.209 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1473.3 ± 0.2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 76
• Hermann-Mauguin space group symbol: P 41
• Hall space group symbol: P 4w
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1304
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.385
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No