Information card for entry 8107686

Structure parameters

• Formula: C44 H36 N6 S2 Zn
• Calculated formula: C44 H36 N6 S2 Zn
• Title of publication: Crystal structure of bis{N′-[1,3-diphenylprop-2-en-1-ylidene]-N-phenylcarbamohydrazonothioato}zinc(II), C44H36N6S2Zn
• Authors of publication: Tan, Ming Yueh; Crouse, Karen A.; Tan, Sang Loon; Tiekink, Edward R. T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 6
• Pages of publication: 1145 - 1148
• a: 14.5676 ± 0.0004 Å
• b: 26.1767 ± 0.0008 Å
• c: 10.0963 ± 0.0003 Å
• α: 90°
• β: 99.14 ± 0.003°
• γ: 90°
• Cell volume: 3801.2 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0539
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No