Information card for entry 4328508

Structure parameters

• Chemical name: hexacarbonylbis(μ-phenolato)(μ-pyridazine-κN1:κN2)dirhenium dichloromethane solvate
• Formula: C22.5 H15 Cl N2 O8 Re2
• Calculated formula: C22.5 H15 Cl N2 O8 Re2
• Title of publication: Electrochemical, Computational, and Photophysical Characterization of New Luminescent Dirhenium-Pyridazine Complexes Containing Bridging OR or SR Anions
• Authors of publication: Alessio Raimondi; Monica Panigati; Daniela Maggioni; Laura D'Alfonso; Pierluigi Mercandelli; Patrizia Mussini; Giuseppe D'Alfonso
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 2966 - 2975
• a: 8.86 ± 0.002 Å
• b: 12.518 ± 0.002 Å
• c: 23.094 ± 0.002 Å
• α: 90°
• β: 96.1 ± 0.02°
• γ: 90°
• Cell volume: 2546.8 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.0518
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No