Information card for entry 7239037

Structure parameters

• Formula: C20 H17 N2 O5
• Calculated formula: C20 H17 N2 O5
• Title of publication: Stereoselective synthesis of highly functionalized tetrahydrocarbazoles through a domino Michael‒Henry reaction: an easy access to four contiguous chiral centers
• Authors of publication: Jaiswal, Pradeep Kumar; Biswas, Soumen; Singh, Shivendra; Pathak, Biswarup; Mobin, Shaikh M.; Samanta, Sampak
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 27
• Pages of publication: 10644
• a: 9.0098 ± 0.0008 Å
• b: 11.0194 ± 0.0011 Å
• c: 18.008 ± 0.002 Å
• α: 90°
• β: 101.284 ± 0.01°
• γ: 90°
• Cell volume: 1753.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• 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
• Residual factor for all reflections: 0.1045
• Residual factor for significantly intense reflections: 0.0962
• Weighted residual factors for significantly intense reflections: 0.244
• Weighted residual factors for all reflections included in the refinement: 0.2504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No