Information card for entry 2201288

Structure parameters

• Chemical name: trans-3,3'-Bis(diphenylhydroxymethyl)stilbene-benzene (3/4)
• Formula: C144 H120 O6
• Calculated formula: C144 H120 O6
• SMILES: C(c1ccccc1)(O)(c1ccccc1)c1cccc(c1)/C=C/c1cc(ccc1)C(O)(c1ccccc1)c1ccccc1.c1ccccc1.c1ccccc1
• Title of publication: <i>trans</i>-3,3'-Bis(diphenylhydroxymethyl)stilbene‒benzene (3/4)
• Authors of publication: Ohba, Shigeru; Hiratsuka, Takaichi; Tanaka, Koichi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: o1013 - o1015
• a: 12.972 ± 0.002 Å
• b: 23.653 ± 0.004 Å
• c: 9.304 ± 0.004 Å
• α: 100.61 ± 0.02°
• β: 98.53 ± 0.02°
• γ: 96.03 ± 0.013°
• Cell volume: 2749 ± 1.4 ų
• Cell temperature: 297.2 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 significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 0.969
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No