Information card for entry 4109948

Structure parameters

• Common name: 2
• Formula: C19 H23 N O2
• Calculated formula: C19 H23 N O2
• SMILES: c1cccc2c1N([C@@H]1[C@@]32CC(=O)O[C@]3(C=C1C)CCCC)C.c1cccc2c1N([C@H]1[C@]32CC(=O)O[C@@]3(C=C1C)CCCC)C
• Title of publication: PtCl2-Catalyzed Rapid Access to Tetracyclic 2,3-Indoline-Fused Cyclopentenes: Reactivity Divergent from Cationic Au(I) Catalysis and Synthetic Potential
• Authors of publication: Guozhu Zhang; Vincent J. Catalano; Liming Zhang
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 11358 - 11359
• a: 7.9387 ± 0.0002 Å
• b: 9.9181 ± 0.0002 Å
• c: 10.4955 ± 0.0002 Å
• α: 93.249 ± 0.001°
• β: 107.568 ± 0.001°
• γ: 94.082 ± 0.001°
• Cell volume: 783.18 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1256
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No