Information card for entry 8105020

Structure parameters

• Formula: C33 H32 F2 N4 O5 Zn
• Calculated formula: C33 H32 F2 N4 O5 Zn
• SMILES: c12cc(ccc1C=[N](c1ccc(cc1)/C(=N/OC)C)[Zn]1([N](=Cc3c(cc(cc3)F)O1)c1ccc(cc1)C(=N\OC)\C)O2)F.CO
• Title of publication: Synthesis and crystal structure of bis(2-(((4-(1-(ethoxyimino)ethyl)phenyl)imino)methyl)-5-fluorophenolato-κ2N,O)zinc(II) - methanol (1/1), C33H32F2N4O4Zn
• Authors of publication: Zhao, Ji-Xing
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 235
• Journal issue: 1
• Pages of publication: 69 - 71
• a: 9.5132 ± 0.0005 Å
• b: 13.0781 ± 0.0006 Å
• c: 14.0448 ± 0.0006 Å
• α: 63.095 ± 0.001°
• β: 73.564 ± 0.001°
• γ: 78.87 ± 0.002°
• Cell volume: 1490.24 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 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: 0.0776
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No