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https://hdl.handle.net/2440/90104
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dc.contributor.author | Burrett, S. | - |
dc.contributor.author | Taylor, D. | - |
dc.contributor.author | Tiekink, E. | - |
dc.date.issued | 2014 | - |
dc.identifier.citation | Acta Crystallographica Section E: Structure Reports Online, 2014; 70(7):776-777 | - |
dc.identifier.issn | 1600-5368 | - |
dc.identifier.issn | 1600-5368 | - |
dc.identifier.uri | http://hdl.handle.net/2440/90104 | - |
dc.description | Includes 18 pages of supporting information, pp. sup. 1-sup.18 | - |
dc.description.abstract | Four independent mol-ecules (A-D) comprise the asymmetric unit of the title compound, C15H26O2, which differ only in the relative orientations of the terminal -C(Me)2OH groups [e.g. the range of Cmethyl-ene-Cmethine-Cquaternary-Ohy-droxy torsion angles is 52.7 (7)-57.1 (6)°, where the Cmethyl-ene atom is bound to an epoxide C atom]. The five-membered rings adopt envelope conformations, with the methyl-ene C atom adjacent to the methine C atom being the flap atom in each case. In each mol-ecule, the conformation of the seven-membered ring is a half-chair, with the Cmethyl-ene-Cmethine bond, flanked by methyl-ene C atoms, being the back of the chair. Supra-molecular helical chains along the b axis are found in the crystal packing, sustained by hy-droxy-epoxide O-H⋯O hydrogen bonding. Mol-ecules of A self-associate into a chain as do those of D. A third independent chain comprising B and C mol-ecules is also formed. The studied crystal is a pseudo-merohedral twin (minor component ca 21%). | - |
dc.description.statementofresponsibility | Stacey Burrett, Dennis K. Taylor and Edward R. T. Tiekink | - |
dc.language.iso | en | - |
dc.publisher | International Union of Crystallography | - |
dc.rights | Copyright © International Union of Crystallography | - |
dc.source.uri | http://dx.doi.org/10.1107/s1600536814013543 | - |
dc.title | 2-[(3S,3aS,5R,8S,8aS)-3,8-Dimethylhexahydro-1H,4H-3a,8a-epoxyazulen-5-yl] -propan-2-ol | - |
dc.type | Journal article | - |
dc.identifier.doi | 10.1107/S1600536814013543 | - |
pubs.publication-status | Published | - |
dc.identifier.orcid | Taylor, D. [0000-0002-3302-4610] [0000-0002-4274-3983] [0000-0003-0633-7424] | - |
Appears in Collections: | Agriculture, Food and Wine publications Aurora harvest 2 |
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