Information card for entry 4500000

Structure parameters

• Formula: C24 H18 N2 O7
• Calculated formula: C24 H18 N2 O7.07
• Title of publication: Crystal Engineering of the Composition of Pharmaceutical Phases: Multiple-Component Crystalline Solids Involving Carbamazepine
• Authors of publication: Scott G. Fleischman; Srinivasan S. Kuduva; Jennifer A. McMahon; Brian Moulton; Rosa D. Bailey Walsh; Naír Rodríguez-Hornedo; Michael J. Zaworotko
• Journal of publication: Crystal Growth & Design
• Year of publication: 2003
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 909 - 919
• a: 32.531 ± 0.005 Å
• b: 5.2697 ± 0.0008 Å
• c: 24.159 ± 0.004 Å
• α: 90°
• β: 98.191 ± 0.003°
• γ: 90°
• Cell volume: 4099.3 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1857
• Residual factor for significantly intense reflections: 0.1556
• Weighted residual factors for significantly intense reflections: 0.348
• Weighted residual factors for all reflections included in the refinement: 0.3607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.284
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No