Information card for entry 2103415

Structure parameters

• Chemical name: 4-Methyl-2,6-bis(4-methylbenzylidene)cyclohexanone
• Formula: C23 H24 O
• Calculated formula: C23 O
• SMILES: CC1CC(=Cc2ccc(cc2)C)C(C(C1)=Cc1ccc(cc1)C)=O
• Title of publication: Some errors from the crystallographic literature, some amplifications and a questionable result
• Authors of publication: Herbstein, Frank H.; Hu, Shengzhi; Kapon, Moshe
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 5
• Pages of publication: 884 - 892
• a: 19.531 Å
• b: 11.459 Å
• c: 8.067 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1805.44 ų
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 3
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No