Information card for entry 2001081

Structure parameters

• Formula: C18 H16 O
• Calculated formula: C18 H16 O
• SMILES: O=C1C=CC(C=C1)(c1ccccc1)c1ccccc1
• Title of publication: Structure of 4,4-diphenylcyclohex-2-en-1-one (monoclinic form)
• Authors of publication: Ariel, S.; Chen, J.; Scheffer, J. R.; Trotter, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 2
• Pages of publication: 400 - 402
• a: 7.139 ± 0.006 Å
• b: 15.823 ± 0.002 Å
• c: 12.472 ± 0.005 Å
• α: 90°
• β: 103.12 ± 0.09°
• γ: 90°
• Cell volume: 1372 ± 1 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No