Information card for entry 4330964

Structure parameters

• Formula: C28 H34 N2 O17 Re2
• Calculated formula: C28 H34 N2 O17 Re2
• Title of publication: Coordinated Aqua vs Methanol Substitution Kinetics in fac-Re(I) Tricarbonyl Tropolonato Complexes
• Authors of publication: Marietjie Schutte; Andreas Roodt; Hendrik G. Visser
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 11996 - 12006
• a: 14.5451 ± 0.0007 Å
• b: 10.3208 ± 0.0004 Å
• c: 11.6201 ± 0.0004 Å
• α: 90°
• β: 90.372 ± 0.004°
• γ: 90°
• Cell volume: 1744.34 ± 0.12 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 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: 0.0866
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No