Information card for entry 2010429

Structure parameters

• Formula: C26 H46
• Calculated formula: C26 H46
• SMILES: C=C(C(C)(C)C)/C=C(C(C)(C)C)\CC/C(=C\C(=C)C(C)(C)C)C(C)(C)C
• Title of publication: 2,4,7,9-Tetra-<i>tert</i>-butyl-1,3,7,9-decatetraene
• Authors of publication: Overby, J.S.; Hanusa, T.P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 2
• Pages of publication: 313 - 315
• a: 9.559 ± 0.002 Å
• b: 12.464 ± 0.002 Å
• c: 10.478 ± 0.002 Å
• α: 90°
• β: 94.37 ± 0.01°
• γ: 90°
• Cell volume: 1244.8 ± 0.4 ų
• Cell temperature: 293 ± 1 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.05
• Goodness-of-fit parameter for significantly intense reflections: 1.54
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No