Information card for entry 4516512

Structure parameters

• Formula: C17 H17 Cl N4 O5 S
• Calculated formula: C17 H17 Cl N4 O5 S
• Title of publication: Furosemide Cocrystals with Pyridines: An Interesting Case of Color Cocrystal Polymorphism
• Authors of publication: Sangtani, Ekta; Sahu, Sanjay K.; Thorat, Shridhar H.; Gawade, Rupesh L.; Jha, Kunal K.; Munshi, Parthapratim; Gonnade, Rajesh G.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 12
• Pages of publication: 5858
• a: 8.5913 ± 0.0002 Å
• b: 12.9773 ± 0.0003 Å
• c: 17.6723 ± 0.0004 Å
• α: 84.436 ± 0.001°
• β: 84.939 ± 0.001°
• γ: 75.455 ± 0.001°
• Cell volume: 1894.01 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0499
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No