Information card for entry 2007536

Structure parameters

• Chemical name: 9,10-dihydro-1,4-dimethoxy-5,8-dimethyl-cis-9,10-diphenyl- 9,10-anthracenediol
• Formula: C30 H28 O4
• Calculated formula: C30 H28 O4
• SMILES: c1(ccc(c2c1[C@@](c1c(ccc(c1[C@@]2(O)c1ccccc1)C)C)(O)c1ccccc1)OC)OC
• Title of publication: 9,10-Dihydro-1,4-dimethoxy-5,8-dimethyl-<i>cis</i>-9,10-diphenyl-9,10-anthracenediol, a Crowded Planar 9,10-Dihydroanthracene
• Authors of publication: Krieger, Claus; Wartini, Alexander R.; Neugebauer, Franz A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 1125 - 1127
• a: 8.229 ± 0.003 Å
• b: 11.522 ± 0.003 Å
• c: 14.43 ± 0.004 Å
• α: 66.33 ± 0.02°
• β: 79.23 ± 0.02°
• γ: 70.08 ± 0.02°
• Cell volume: 1176.1 ± 0.7 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 294 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 significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for significantly intense reflections: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No