Information card for entry 7249629

Structure parameters

• Formula: C46 H30 Cl10 N6 S2 Zn
• Calculated formula: C46 H30 Cl10 N6 S2 Zn
• Title of publication: Positional isomers of (E)-2-(anthracen-9-ylmethylene)-N-(aryl)hydrazinecarbothioamide, zinc complexes and polymorphic solvates
• Authors of publication: Nath, Jitendra; Baruah, Jubaraj B.
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 1
• Pages of publication: 46 - 54
• a: 24.961 ± 0.006 Å
• b: 17.276 ± 0.004 Å
• c: 14.02 ± 0.003 Å
• α: 90°
• β: 122.367 ± 0.007°
• γ: 90°
• Cell volume: 5106 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0907
• Residual factor for significantly intense reflections: 0.0773
• Weighted residual factors for significantly intense reflections: 0.221
• Weighted residual factors for all reflections included in the refinement: 0.2322
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No