Information card for entry 2231296

Structure parameters

• Common name: 1,8-bis(2-naphthoyl)-2,7-dimethoxynaphthalene
• Chemical name: [2,7-Dimethoxy-8-(2-naphthoyl)naphthalen-1-yl](naphthalen-2-yl)methanone
• Formula: C34 H24 O4
• Calculated formula: C34 H24 O4
• SMILES: COc1ccc2c(c1C(=O)c1ccc3c(c1)cccc3)c(c(cc2)OC)C(=O)c1ccc2c(c1)cccc2
• Title of publication: [2,7-Dimethoxy-8-(2-naphthoyl)naphthalen-1-yl](naphthalen-2-yl)methanone
• Authors of publication: Tsumuki, Takehiro; Hijikata, Daichi; Okamoto, Akiko; Oike, Hideaki; Yonezawa, Noriyuki
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o2095
• a: 12.8325 ± 0.0005 Å
• b: 12.2459 ± 0.0004 Å
• c: 15.8798 ± 0.0006 Å
• α: 90°
• β: 97.618 ± 0.001°
• γ: 90°
• Cell volume: 2473.41 ± 0.16 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0456
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.1036
• Weighted residual factors for all reflections included in the refinement: 0.1152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes