Information card for entry 2004292

Structure parameters

• Formula: C15 H22 N O4 Rh
• Calculated formula: C15 H22 N O4 Rh
• SMILES: [Rh]123456(OC(=O)C(=O)O1)[N](CC[c]16[c]2([c]3([c]4([c]51C)C)C)C)(C)C
• Title of publication: Intramolecular Coordination of the Dimethylamino Group in a Rhodium‒Oxalate Complex with the 1-[2-(Dimethylamino)ethyl]-2,3,4,5-tetramethylcyclopentadienyl Ligand
• Authors of publication: Stammler, H.-G.; Jutzi, P.; Neumann, B.; Kristen, M. O.; Hölscher, H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2494 - 2496
• a: 12.785 ± 0.005 Å
• b: 9.265 ± 0.004 Å
• c: 12.881 ± 0.004 Å
• α: 90°
• β: 97.39 ± 0.03°
• γ: 90°
• Cell volume: 1513.1 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.1236
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections: 0.1694
• Weighted residual factors for significantly intense reflections: 0.1147
• Goodness-of-fit parameter for all reflections: 1.126
• Goodness-of-fit parameter for significantly intense reflections: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No