Information card for entry 2000296

Structure parameters

• Formula: C23 H31 N O2
• Calculated formula: C23 H31 N O2
• SMILES: O=C(N[C@@H]1C[C@H](CC=C1C)C(=C)C)O[C@@H]1CCCC[C@H]1c1ccccc1
• Title of publication: The structure at 198 K of (1<i>R</i>,5<i>R</i>,15<i>R</i>,16<i>R</i>)-5-isopropenyl-2-methyl-1-[<i>N</i>-(<i>trans</i>-2-phenylcyclohexyloxycarbonyl)amino]-2-cyclohexene
• Authors of publication: Lynch, V. M.; Yaser, H. K.; Whitesell, J. K.; Davis, B. E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1991
• Journal volume: 47
• Journal issue: 7
• Pages of publication: 1566 - 1568
• a: 8.813 ± 0.002 Å
• b: 9.043 ± 0.002 Å
• c: 25.643 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2043.6 ± 0.8 ų
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No