Information card for entry 3000279

Structure parameters

• Chemical name: 6,6'-bis(N,N-dimethylamino)-2,2'-bibenzothiazole
• Formula: C18 H18 N4 S2
• Authors of publication: Erik Rakovský; Hrobárik, Peter; Osuský, Patrik; Smolíček, Maroš
• Journal of publication: To be published
• a: 7.6141 ± 0.0005 Å
• b: 7.7816 ± 0.0005 Å
• c: 8.7101 ± 0.0005 Å
• α: 65.948 ± 0.004°
• β: 68.659 ± 0.005°
• γ: 62.896 ± 0.004°
• Cell volume: 409.3 ± 0.05 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No