Information card for entry 4027928

Structure parameters

• Formula: C132 H114 Br7 N12 O10
• Calculated formula: C132 H114 Br7 N12 O10
• Title of publication: Fluorescent Tris-Imidazolium Sensors for Picric Acid Explosive
• Authors of publication: Bijan Roy; Arun Kumar Bar; Bappaditya Gole; Partha Sarathi Mukherjee
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2013
• Journal volume: 78
• Pages of publication: 1306 - 1310
• a: 38.905 ± 0.005 Å
• b: 15.3839 ± 0.0019 Å
• c: 19.874 ± 0.002 Å
• α: 90°
• β: 103.18 ± 0.003°
• γ: 90°
• Cell volume: 11581 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.2367
• Residual factor for significantly intense reflections: 0.115
• Weighted residual factors for significantly intense reflections: 0.3398
• Weighted residual factors for all reflections included in the refinement: 0.4005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.186
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No