Information card for entry 2001678

Structure parameters

• Formula: C21 H28 N2
• Calculated formula: C21 H28 N2
• SMILES: C1CCN2[C@H](C1)[C@H]1C[C@@H](C2)[C@H]2N(C1)C(=CCC2)c1ccccc1
• Title of publication: Structure of 15-phenyl-14-dehydrosparteine
• Authors of publication: Katrusiak, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 900 - 902
• a: 8.959 ± 0.001 Å
• b: 14.137 ± 0.001 Å
• c: 13.934 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1764.8 ± 0.3 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No