Information card for entry 2007779

Structure parameters

• Formula: C13 H10 Cl N2 O3 Re
• Calculated formula: C13 H10 Cl N2 O3 Re0.5
• Title of publication: <i>fac</i>-Tricarbonylchlorobis(pyridine-<i>N</i>)rhenium and <i>fac</i>-Tricarbonylchlorobis(4,4'-bipyridine-<i>N</i>)rhenium
• Authors of publication: Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 11
• Pages of publication: 1596 - 1600
• a: 7.4173 ± 0.0011 Å
• b: 14.326 ± 0.002 Å
• c: 13.077 ± 0.003 Å
• α: 90°
• β: 90.14 ± 0.013°
• γ: 90°
• Cell volume: 1389.6 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0221
• Residual factor for significantly intense reflections: 0.015
• Weighted residual factors for all reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.019
• Goodness-of-fit parameter for all reflections: 1.888
• Goodness-of-fit parameter for significantly intense reflections: 1.95
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No