Information card for entry 7249634

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: 25.202 ± 0.002 Å
• b: 9.4183 ± 0.0009 Å
• c: 20.248 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4806.1 ± 0.8 ų
• Cell temperature: 144 ± 2 K
• Ambient diffraction temperature: 144 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1734
• Weighted residual factors for all reflections included in the refinement: 0.1827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No