Information card for entry 8101121

Structure parameters

• Formula: C12 H13 N O
• Calculated formula: C12 H13 N O
• SMILES: C1(C(=CCCC1)c1ccccc1)=NO
• Title of publication: Crystal structure of 2-phenyl-2-cyclohexene-1-one oxime, C~12~H~13~NO
• Authors of publication: Meenakshi, C.; Ramamoorthy, V.; Muthusubramanian, S.; Sivasubramanian, S.; Ziegler, T.; Lex, J.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 4
• Pages of publication: 649 - 650
• a: 6.276 ± 0.001 Å
• b: 8.914 ± 0.001 Å
• c: 10.151 ± 0.001 Å
• α: 68.4 ± 0.01°
• β: 77.04 ± 0.01°
• γ: 76.21 ± 0.01°
• Cell volume: 506.9 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No