Information card for entry 7100997

Structure parameters

• Common name: Mirtazapine and Saccharin molecular complex water structure
• Formula: C24 H28 N4 O4.34 S
• Calculated formula: C24 H26.66 N4 O4.33 S
• Title of publication: Saccharin as a salt former. Enhanced solubilities of saccharinates of active pharmaceutical ingredients.
• Authors of publication: Prashant M. Bhatt; Nittala V. Ravindra; Rahul Banerjee; Gautam R. Desiraju
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 9.5791 ± 0.0012 Å
• b: 26.733 ± 0.003 Å
• c: 9.4055 ± 0.0012 Å
• α: 90°
• β: 109.511 ± 0.002°
• γ: 90°
• Cell volume: 2270.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No