Information card for entry 7232660

Structure parameters

• Formula: C23 H17 N O2 S
• Calculated formula: C23 H17 N O2 S
• Title of publication: Convenient and efficient synthesis of novel 11H-benzo[5,6][1,4]thiazino[3,4-a]isoindol-11-ones derived from 2-bromo-(2/3-substitutedphenyl)-1H-indene-1,3(2H)-diones
• Authors of publication: Mor, Satbir; Sindhu, Suchita
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 23
• Pages of publication: 12784
• a: 8.0068 ± 0.0007 Å
• b: 9.5362 ± 0.001 Å
• c: 12.255 ± 0.0009 Å
• α: 95.494 ± 0.003°
• β: 98.424 ± 0.003°
• γ: 97.562 ± 0.004°
• Cell volume: 911.24 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0667
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1469
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No