Information card for entry 2232430

Structure parameters

• Chemical name: (<i>E</i>)-2-(2-Methylcyclohexylidene)hydrazinecarbothioamide
• Formula: C8 H15 N3 S
• Calculated formula: C8 H15 N3 S
• SMILES: S=C(N/N=C\1C(CCCC1)C)N
• Title of publication: (<i>E</i>)-2-(2-Methylcyclohexylidene)hydrazinecarbothioamide
• Authors of publication: Hicks, Justin W.; Lough, Alan J.; Wilson, Alan A.; Vasdev, Neil
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o3005
• a: 6.0261 ± 0.0005 Å
• b: 8.0655 ± 0.0004 Å
• c: 10.9129 ± 0.0009 Å
• α: 83.904 ± 0.005°
• β: 89.386 ± 0.004°
• γ: 68.416 ± 0.004°
• Cell volume: 490.19 ± 0.06 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes