Information card for entry 4516035

Structure parameters

• Formula: C37 H40 Cl2 N6 O8
• Calculated formula: C37 H40 Cl2 N6 O8
• Title of publication: Salts of Amoxapine with Improved Solubility for Enhanced Pharmaceutical Applicability.
• Authors of publication: Joshi, Mayank; Roy Choudhury, Angshuman
• Journal of publication: ACS omega
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 2
• Pages of publication: 2406 - 2416
• a: 21.344 ± 0.0009 Å
• b: 9.9544 ± 0.0004 Å
• c: 17.4685 ± 0.0008 Å
• α: 90°
• β: 102.041 ± 0.004°
• γ: 90°
• Cell volume: 3629.8 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0712
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.138
• Weighted residual factors for all reflections included in the refinement: 0.1475
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No