Information card for entry 2220199

Structure parameters

• Chemical name: Benzyl N'-(1<i>H</i>-indol-2-ylmethylene)hydrazinecarbodithioate ethanol hemisolvate
• Formula: C18 H18 N3 O0.5 S2
• Calculated formula: C18 H18 N3 O0.5 S2
• Title of publication: Benzyl <i>N</i>'-(1<i>H</i>-indol-2-ylmethylene)hydrazinecarbodithioate ethanol hemisolvate
• Authors of publication: Khaledi, Hamid; Mohd Ali, Hapipah; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2445
• a: 13.4225 ± 0.0002 Å
• b: 15.4088 ± 0.0002 Å
• c: 16.812 ± 0.0003 Å
• α: 90°
• β: 102.637 ± 0.001°
• γ: 90°
• Cell volume: 3392.9 ± 0.09 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: 0.0405
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes