Information card for entry 4108482

Structure parameters

• Formula: C19 H25 Cl N3 Rh
• Calculated formula: C19 H25 Cl N3 Rh
• SMILES: c1(c(c2ccccc2)[n+](C)nn1CC)[Rh]123([CH]4=[CH]1CC[CH]2=[CH]3CC4)Cl
• Title of publication: 1,2,3-Triazolylidenes as Versatile Abnormal Carbene Ligands for Late Transition Metals
• Authors of publication: Paulson Mathew; Antonia Neels; Martin Albrecht
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 13534 - 13535
• a: 9.7329 ± 0.0008 Å
• b: 17.7673 ± 0.0019 Å
• c: 11.0845 ± 0.001 Å
• α: 90°
• β: 103.598 ± 0.01°
• γ: 90°
• Cell volume: 1863.1 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1259
• Weighted residual factors for all reflections included in the refinement: 0.1329
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No