Information card for entry 1559510

Structure parameters

• Common name: (+)-(Z)-fenchone oxime], (+)-(Z)-1,3,3-trimethyl-anti-7-chlorobicyclo[2.2.1]heptan-2-one oxime
• Formula: C10 H17 N O
• Calculated formula: C10 N O
• SMILES: ON=C1[C@]2(CC[C@@H](C1(C)C)C2)C
• Title of publication: X-Ray Diffraction Study on (+)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one {(+)-Fenchone} (Z)-Oxime, Two Monochloro Derivatives and a Dehydrohalogenation Product
• Authors of publication: Rissanen, Kari; Laihia, Katri; Korvola, Jorma; Kolehmainen, Erkki
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1991
• Journal volume: 45
• Pages of publication: 751 - 757
• a: 6.219 ± 0.002 Å
• b: 11.25 ± 0.001 Å
• c: 14.475 ± 0.001 Å
• α: 90°
• β: 100.64 ± 0.01°
• γ: 90°
• Cell volume: 995.3 ± 0.3 ų
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 0.65
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No