Information card for entry 2000335

Structure parameters

• Formula: C20 H22 N2 O4
• Calculated formula: C20 H22 N2 O4
• SMILES: N1C(=O)[C@]2(c3ccccc13)CCN1C(=O)/C(=C/C)[C@H](C[C@@H]21)CC(=O)OC.N1C(=O)[C@@]2(c3ccccc13)CCN1C(=O)/C(=C/C)[C@@H](C[C@H]21)CC(=O)OC
• Title of publication: Structure of (±)-7(<i>S</i>)-16-deformyl-21-oxogeissoschizine‒oxindole
• Authors of publication: Lynch, V. M.; Mortimore, M.; Martin, S. F.; Davis, B. E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1991
• Journal volume: 47
• Journal issue: 4
• Pages of publication: 908 - 910
• a: 10.5052 ± 0.0007 Å
• b: 16.442 ± 0.002 Å
• c: 10.3415 ± 0.0008 Å
• α: 90°
• β: 95.358 ± 0.006°
• γ: 90°
• Cell volume: 1778.4 ± 0.3 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No