Information card for entry 4338119

Structure parameters

• Common name: JBWW16
• Formula: C28.5 H36 B Cl2 Co F2 I2 N7 O4.5
• Calculated formula: C28.5 H33.5 B Cl2 Co F2 I2 N7 O4.5
• Title of publication: Light-Driven Hydrogen Evolution by BODIPY-Sensitized Cobaloxime Catalysts.
• Authors of publication: Bartelmess, Juergen; Francis, Aaron J.; El Roz, Karim A.; Castellano, Felix N.; Weare, Walter W.; Sommer, Roger D.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 4527 - 4534
• a: 8.6647 ± 0.0004 Å
• b: 13.9199 ± 0.0005 Å
• c: 16.055 ± 0.0006 Å
• α: 101.352 ± 0.002°
• β: 102.329 ± 0.002°
• γ: 95.691 ± 0.002°
• Cell volume: 1834.49 ± 0.13 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.06
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No