Information card for entry 2008048

Structure parameters

• Common name: dineopentylprehnitene
• Formula: C20 H34
• Calculated formula: C20 H34
• SMILES: Cc1c(CC(C)(C)C)c(CC(C)(C)C)c(c(c1C)C)C
• Title of publication: Dineopentylprehnitene (1,2,3,4-tetramethyl-5,6-dineopentylbenzene) at 296 and 223K
• Authors of publication: Gerkin, Roger E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 79 - 82
• a: 30.439 ± 0.002 Å
• b: 6.314 ± 0.003 Å
• c: 19.663 ± 0.003 Å
• α: 90°
• β: 106.06 ± 0.01°
• γ: 90°
• Cell volume: 3631.6 ± 1.8 ų
• Cell temperature: 223 K
• Ambient diffraction temperature: 223 K
• Number of distinct elements: 2
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.107
• Goodness-of-fit parameter for significantly intense reflections: 1.8
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No