Information card for entry 7231996

Structure parameters

• Chemical name: 2-[(1<i>E</i>)-[(2<i>Z</i>)-2-[(ethylsulfanyl)({[(1<i>E</i>)-(ethylsulfanyl)[(<i>Z</i>)-2-[(2-hydroxyphenyl)methylidene]hydrazin-1-ylidene]methyl]disulfanyl})methylidene]hydrazin-1-ylidene]methyl]phenol
• Formula: C20 H22 N4 O2 S4
• Calculated formula: C20 H22 N4 O2 S4
• Title of publication: Molecular design and synthesis of new dithiocarbazate complexes; crystal structure, bioactivities and nano studies
• Authors of publication: Yekke-ghasemi, Zahra; Takjoo, Reza; Ramezani, Mohammad; Mague, Joel T.
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 73
• Pages of publication: 41795
• a: 23.712 ± 0.002 Å
• b: 9.1025 ± 0.0008 Å
• c: 10.4517 ± 0.0009 Å
• α: 90°
• β: 105.353 ± 0.001°
• γ: 90°
• Cell volume: 2175.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0507
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No