Information card for entry 2003599

Structure parameters

• Chemical name: 2α,3α,7β,13β-diépoxy-trans-himachalane.
• Formula: C15 H24 O2
• Calculated formula: C15 H24 O2
• SMILES: CC1(C)CCC[C@]2([C@@H]3[C@@H]1[C@@H]1O[C@]1(C)CC3)CO2
• Title of publication: 2α,3α:7β,13β-Diépoxy-<i>trans</i>-himachalane
• Authors of publication: Chiaroni, A.; Riche, C.; Benharref, A.; El Jamili, H.; Lassaba, E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 6
• Pages of publication: 1171 - 1173
• a: 8.017 ± 0.002 Å
• b: 11.103 ± 0.003 Å
• c: 8.263 ± 0.003 Å
• α: 90°
• β: 111.53 ± 0.04°
• γ: 90°
• Cell volume: 684.2 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.075
• Goodness-of-fit parameter for significantly intense reflections: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No