Information card for entry 2243268

Structure parameters

• Chemical name: Bis{3,4,5-trimethoxy-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]benzohydrazidato}zinc(II)
• Formula: C37 H46 N6 O10 Zn
• Calculated formula: C37 H36 N6 O10 Zn
• SMILES: [Zn]1234([n]5ccccc5C(=[N]1N=C(O3)c1cc(OC)c(OC)c(OC)c1)C)[n]1ccccc1C(=[N]2N=C(O4)c1cc(OC)c(OC)c(OC)c1)C.CO.C(O)C
• Title of publication: Crystal structure of the mixed methanol and ethanol solvate of bis{3,4,5-trimethoxy-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]benzohydrazidato}zinc(II)
• Authors of publication: Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Seredyuk, Maksym
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 3
• Pages of publication: 303 - 308
• a: 11.0402 ± 0.0004 Å
• b: 13.8056 ± 0.0008 Å
• c: 14.419 ± 0.0007 Å
• α: 63.256 ± 0.005°
• β: 74.098 ± 0.004°
• γ: 75.307 ± 0.004°
• Cell volume: 1865.63 ± 0.18 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0812
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1712
• Weighted residual factors for all reflections included in the refinement: 0.1922
• Goodness-of-fit parameter for all reflections included in the refinement: 0.895
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes