Information card for entry 2008377

Structure parameters

• Chemical name: 1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine.
• Formula: C8 H16 N2 O
• Calculated formula: C8 H16 N2 O
• SMILES: CC(=O)N/N=C(C(C)(C)C)\C
• Title of publication: 1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine: a monoclinic crystal structure with local orthorhombic pseudosymmetry
• Authors of publication: Bats, Jan W.; Grundl, Marc A.; Hashmi, A. Stephen K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 4
• Pages of publication: 689 - 691
• a: 12.5516 ± 0.0015 Å
• b: 7.6362 ± 0.0007 Å
• c: 19.828 ± 0.002 Å
• α: 90°
• β: 94.049 ± 0.011°
• γ: 90°
• Cell volume: 1895.7 ± 0.3 ų
• Cell temperature: 134 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.053
• Goodness-of-fit parameter for significantly intense reflections: 1.283
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No