{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["68(Pt 6)"],"submitter":["Paramasivam S"],"pubmed_abstract":["The title compound, C(25)H(22)N(2)O(3), with three stereogenic centres, crystallizes in a centrosymmetric space group as a racemate. The pyran ring adopts a sofa conformation and the five-membered isoxazole ring exhibits an envelope conformation. The dihedral angle between the benzene ring and the mean plane through the near coplanar atoms of the pyran ring is 10.54 (9)°. In the crystal, no significant intermolecular interactions are observed."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1660"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC3379258"],"repository":["biostudies-literature"],"pubmed_title":["rac-6-Eth-oxy-3,3a,4,9b-tetra-hydro-1,3-diphenyl-1H-chromeno[4,3-c]isoxazole-3a-carbonitrile."],"pmcid":["PMC3379258"],"pubmed_authors":["Srinivasan J","Paramasivam S","Seshadri PR","Bakthadoss M"],"additional_accession":[]},"is_claimable":false,"name":"rac-6-Eth-oxy-3,3a,4,9b-tetra-hydro-1,3-diphenyl-1H-chromeno[4,3-c]isoxazole-3a-carbonitrile.","description":"The title compound, C(25)H(22)N(2)O(3), with three stereogenic centres, crystallizes in a centrosymmetric space group as a racemate. The pyran ring adopts a sofa conformation and the five-membered isoxazole ring exhibits an envelope conformation. The dihedral angle between the benzene ring and the mean plane through the near coplanar atoms of the pyran ring is 10.54 (9)°. In the crystal, no significant intermolecular interactions are observed.","dates":{"release":"2012-01-01T00:00:00Z","publication":"2012 Jun","modification":"2025-04-05T13:00:34.268Z","creation":"2019-03-27T00:54:43Z"},"accession":"S-EPMC3379258","cross_references":{"pubmed":["22719456"],"doi":["10.1107/S160053681201906X"]}}