Information card for entry 7233032

Structure parameters

• Formula: C33 H31 N5 O6
• Calculated formula: C33 H31 N5 O6
• Title of publication: Photo-physical Properties of Salts of a Di-topic Imidazole-Tethered Anthracene Derivative in Solid and Solution
• Authors of publication: Baruah, Jubaraj Bikash; Singh, Munendra Pal; Tarai, Arup
• Journal of publication: CrystEngComm
• Year of publication: 2019
• a: 10.674 ± 0.003 Å
• b: 11.727 ± 0.003 Å
• c: 12.647 ± 0.003 Å
• α: 94.364 ± 0.005°
• β: 108.528 ± 0.004°
• γ: 97.669 ± 0.005°
• Cell volume: 1475.7 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1127
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No