Information card for entry 7104511

Structure parameters

• Common name: Biaryl
• Formula: C28 H24 O6
• Calculated formula: C28 H24 O6
• SMILES: O=C(OC)c1c(OC)ccc(c2cccc3c2c(ccc3)c2ccc(OC)c(c2)C(=O)OC)c1
• Title of publication: Novel foldamer structural architecture from cofacial aromatic building blocks.
• Authors of publication: Prabhakaran, Panchami; Puranik, Vedavati G; Chandran, Jima N; Rajamohanan, Pattuparampil R; Hofmann, Hans-Jörg; Sanjayan, Gangadhar J
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 23
• Pages of publication: 3446 - 3448
• a: 8.0132 ± 0.0005 Å
• b: 10.2043 ± 0.0006 Å
• c: 15.3713 ± 0.0009 Å
• α: 86.862 ± 0.001°
• β: 75.932 ± 0.001°
• γ: 67.047 ± 0.001°
• Cell volume: 1121.54 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No