Information card for entry 2004270

Structure parameters

• Chemical name: N-methyl-1,1,4-triphenyl-1,2-dihydronaphthalene-2,3-dicarboximide
• Formula: C31 H23 N O2
• Calculated formula: C31 H23 N O2
• SMILES: N1(C)C(=O)C2C(c3ccccc3)(c3ccccc3)c3c(C(=C2C1=O)c1ccccc1)cccc3
• Title of publication: <i>N</i>-Methyl-1,1,4-triphenyl-1,2-dihydronaphthalene-2,3-dicarboximide
• Authors of publication: Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2722 - 2723
• a: 9.305 ± 0.003 Å
• b: 25.934 ± 0.004 Å
• c: 9.937 ± 0.001 Å
• α: 90°
• β: 99.02 ± 0.01°
• γ: 90°
• Cell volume: 2368.3 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for all reflections: 0.1784
• Weighted residual factors for significantly intense reflections: 0.1562
• Goodness-of-fit parameter for all reflections: 0.985
• Goodness-of-fit parameter for significantly intense reflections: 1.058
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No