Information card for entry 1100183

Structure parameters

• Chemical name: Menthan-7-yl 2,4,7-trimethyl-2,4-trimethylene-5-pentane lactam-7-carboxylate d ichloromethane solvate
• Formula: C23 H39 Cl2 N O3
• Calculated formula: C23 H39 Cl2 N O3
• SMILES: ClCCl.O=C1NC[C@]2(C[C@@]1(C[C@@](C2)(C)C(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C)C)C
• Authors of publication: T.Bach; H.Bergmann; K.Harms
• Journal of publication: Angew.Chem.,Int.Ed.Engl.
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 2302
• a: 8.52 ± 0.001 Å
• b: 12.123 ± 0.001 Å
• c: 24.105 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2489.76 ų
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 6.08
• Weighted residual factors for significantly intense reflections: 6.08
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No