Information card for entry 2007278

Structure parameters

• Chemical name: 2,2'-Bis(1-cyclohexanol)-biphenyl
• Formula: C24 H30 O2
• Calculated formula: C24 H30 O2
• SMILES: c1(c(cccc1)C1(O)CCCCC1)c1c(cccc1)C1(O)CCCCC1
• Title of publication: Structural Investigation of Biphenyl Derivatives
• Authors of publication: Nieger, Martin; Hupfer, Heike; Bolte, Michael
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 656 - 659
• a: 10.082 ± 0.002 Å
• b: 10.187 ± 0.001 Å
• c: 10.304 ± 0.002 Å
• α: 88.5 ± 0.02°
• β: 70.62 ± 0.01°
• γ: 88.19 ± 0.02°
• Cell volume: 997.7 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0642
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No