Information card for entry 2237534

Structure parameters

• Chemical name: <i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine
• Formula: C13 H14 Cl N O
• Calculated formula: C13 H14 Cl N O
• SMILES: O/N=C1/C=C(C)CC(C1)c1cccc(c1)Cl
• Title of publication: <i>N</i>-[(1<i>E</i>)-5-(3-Chlorophenyl)-3-methylcyclohex-2-en-1-ylidene]hydroxylamine
• Authors of publication: Ganesh, G.; Murugavel, K.; Kannan, P. S.; Amirthaganesan, S.; SubbiahPandi, A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 3
• Pages of publication: o449
• a: 19.7898 ± 0.0008 Å
• b: 19.7898 ± 0.0008 Å
• c: 12.4416 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4872.6 ± 0.5 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1024
• Residual factor for significantly intense reflections: 0.0803
• Weighted residual factors for significantly intense reflections: 0.2168
• Weighted residual factors for all reflections included in the refinement: 0.2417
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes