Information card for entry 2000439

Structure parameters

• Formula: C41 H36 N2 O3
• Calculated formula: C41 H36 N2 O3
• SMILES: OC(c1ccccc1)(c1ccccc1)c1cccc(c1)/N=N/c1cccc(c1)C(c1ccccc1)(c1ccccc1)O.CC(=O)C
• Title of publication: Structures of two crystal forms of the host-guest complex between <i>trans</i>-3,3'-bis(diphenylhydroxymethyl)azobenzene and acetone
• Authors of publication: Hamada, K.; Oh-hira, M.; Fujiwara, T.; Toda, F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 11
• Pages of publication: 1969 - 1971
• a: 16.782 ± 0.002 Å
• b: 8.744 ± 0.003 Å
• c: 23.386 ± 0.003 Å
• α: 90°
• β: 107.83 ± 0.02°
• γ: 90°
• Cell volume: 3266.9 ± 1.3 ų
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No