Information card for entry 8106565

Structure parameters

• Formula: C36 H28 Co N6 O4
• Calculated formula: C36 H28 Co N6 O4
• Title of publication: Crystal structure of trans-bis((E)-7-oxo-4-(phenyldiazenyl)cyclohepta-1,3,5-trien-1-olato)-κ2 O,O′)-bis(pyridine-κN)cobalt(II), C36H28CoN6O4
• Authors of publication: Hill, Tania N.; Koen, Renier; Roodt, Andreas
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 3
• Pages of publication: 447 - 449
• a: 6.3166 ± 0.0004 Å
• b: 8.5454 ± 0.0005 Å
• c: 14.8075 ± 0.0009 Å
• α: 105.157 ± 0.002°
• β: 94.494 ± 0.003°
• γ: 101.89 ± 0.002°
• Cell volume: 747.49 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No