Information card for entry 8100832

Structure parameters

• Formula: C23 H27 N3 O2
• Calculated formula: C23 H27 N3 O2
• SMILES: N1(CCc2c(C1)cccc2)C(=O)Oc1cc2[C@]3(CCN([C@H]3N(c2cc1)C)C)C
• Title of publication: Crystal structure of (3aS-cis)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo [2,3-b]indol-5-yl 3,4-dihydro-2(1H)-isoquinolinecarboxylate, C~23~H~27~N~3~O~2~
• Authors of publication: Eriksson, Lars; Wadsten, Tommy; Werner, Per-Erik
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 1
• Pages of publication: 145 - 146
• a: 8.877 ± 0.017 Å
• b: 11.574 ± 0.005 Å
• c: 19.72 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2026 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No