Information card for entry 7023727

Structure parameters

• Common name: JBWW02_B
• Formula: C27 H34 B Cl Co F2 N7 O4
• Calculated formula: C27 H34 B Cl Co F2 N7 O4
• Title of publication: Synthesis, characterization and structural investigation of novel meso-pyridyl BODIPY-cobaloxime complexes.
• Authors of publication: Bartelmess, Juergen; Weare, Walter W.; Sommer, Roger D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 41
• Pages of publication: 14883 - 14891
• a: 16.6111 ± 0.0005 Å
• b: 13.0356 ± 0.0004 Å
• c: 27.7368 ± 0.001 Å
• α: 90°
• β: 90.834 ± 0.002°
• γ: 90°
• Cell volume: 6005.4 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 8
• 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: 0.0654
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.122
• Weighted residual factors for all reflections included in the refinement: 0.1252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No