Information card for entry 7203804

Structure parameters

• Formula: C21 H30 Br N O2
• Calculated formula: C21 H30 Br N O2
• Title of publication: Facile preparation and structure‒property correlation of low molecular mass organic gelators derived from simple organic salts
• Authors of publication: Trivedi, Darshak R.; Ballabh, Amar; Dastidar, Parthasarathi
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2005
• Journal volume: 15
• Journal issue: 26
• Pages of publication: 2606
• a: 5.698 ± 0.002 Å
• b: 12.825 ± 0.005 Å
• c: 15.492 ± 0.006 Å
• α: 105.226 ± 0.006°
• β: 96.024 ± 0.006°
• γ: 96.465 ± 0.006°
• Cell volume: 1074.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0798
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1298
• Weighted residual factors for all reflections included in the refinement: 0.1425
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No