Information card for entry 2235435

Structure parameters

• Chemical name: 6,7,15,16-Tetrahydro-5,14-dibutylbenzo[1,2-<i>c</i>:4,5-<i>c</i>']diacridine
• Formula: C36 H36 N2
• Calculated formula: C36 H36 N2
• SMILES: CCCCc1c2CCc3c(c2nc2c1cccc2)cc1c(c3)c2nc3ccccc3c(c2CC1)CCCC
• Title of publication: 6,7,15,16-Tetrahydro-5,14-dibutylbenzo[1,2-<i>c</i>:4,5-<i>c</i>']diacridine
• Authors of publication: Lu, Xin-hua; Hu, Jin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o2093
• a: 9.601 ± 0.0019 Å
• b: 10.386 ± 0.002 Å
• c: 14.625 ± 0.003 Å
• α: 77.44 ± 0.03°
• β: 78.43 ± 0.03°
• γ: 73.92 ± 0.03°
• Cell volume: 1352.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1172
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1211
• Weighted residual factors for all reflections included in the refinement: 0.1472
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes