Information card for entry 8106842

Structure parameters

• Chemical name: <i>fac</i>-[(Tricarbonyl)(2-(isopropylimino)methyl- 5-methylphenolatido)(pyridinyl)rhenium(I)]
• Formula: C19 H19 N2 O4 Re
• Calculated formula: C19 H19 N2 O4 Re
• Title of publication: Crystal structure of fac-tricarbonyl(2-(isopropylimino)methyl-5-methylphenolatido-κ2 N,O)(pyridine-κN)rhenium(I), C19H19N2O4Re
• Authors of publication: Marake, Daniel Thabo; Roodt, Andreas; Brink, Alice
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 1
• Pages of publication: 251 - 254
• a: 8.2805 ± 0.0003 Å
• b: 13.7325 ± 0.0005 Å
• c: 16.356 ± 0.0006 Å
• α: 90°
• β: 92.431 ± 0.002°
• γ: 90°
• Cell volume: 1858.2 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0423
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No