Information card for entry 8105780

Structure parameters

• Formula: C36 H36 Cl2 Co2 N6 O6
• Calculated formula: C36 H36 Cl2 Co2 N6 O6
• Title of publication: Crystal structure of diaqua-dichlorido-bis(μ2-2-(((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino)methyl)phenolato-κ4 O:O,N,O′)dicobalt(II), C36H36Cl2N6O6Co2
• Authors of publication: Pang, Haixia; He, Xiong; Feng, Xiang; Yuan, Ximing
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 3
• Pages of publication: 563 - 565
• a: 7.4399 ± 0.0009 Å
• b: 9.5362 ± 0.0011 Å
• c: 13.1754 ± 0.0015 Å
• α: 73.589 ± 0.002°
• β: 84.396 ± 0.002°
• γ: 74.709 ± 0.002°
• Cell volume: 864.68 ± 0.18 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0384
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No