{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["65(Pt 8)"],"submitter":["Thomas Gunaseelan A"],"pubmed_abstract":["In the title mol-ecule, C(13)H(13)NO, the dihedral angle between the benzene ring and the fused pyrrole ring is 2.03 (5)°. The methyl group at the 3-position has an equatorial orientation. The cyclo-hexene ring adopts an envelope conformation. Three C atoms of the cyclo-hexene ring, with their attached H atoms, and all atoms of the methyl group are disordered over two positions, the site-occupancy factors being 0.883 (2) and 0.117 (2). In the crystal structure, mol-ecules are stabilized by inter-molecular N-H⋯O hydrogen bonds. A C-H⋯π inter-action, involving the benzene ring, is also found."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1946-7"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC2977477"],"repository":["biostudies-literature"],"pubmed_title":["3-Methyl-3,4-dihydro-9H-carbazol-1(2H)-one."],"pmcid":["PMC2977477"],"pubmed_authors":["Thomas Gunaseelan A","Rajendra Prasad KJ","Thiruvalluvar A","Butcher RJ","Prabakaran K"],"additional_accession":[]},"is_claimable":false,"name":"3-Methyl-3,4-dihydro-9H-carbazol-1(2H)-one.","description":"In the title mol-ecule, C(13)H(13)NO, the dihedral angle between the benzene ring and the fused pyrrole ring is 2.03 (5)°. The methyl group at the 3-position has an equatorial orientation. The cyclo-hexene ring adopts an envelope conformation. Three C atoms of the cyclo-hexene ring, with their attached H atoms, and all atoms of the methyl group are disordered over two positions, the site-occupancy factors being 0.883 (2) and 0.117 (2). In the crystal structure, mol-ecules are stabilized by inter-molecular N-H⋯O hydrogen bonds. A C-H⋯π inter-action, involving the benzene ring, is also found.","dates":{"release":"2009-01-01T00:00:00Z","publication":"2009 Jul","modification":"2025-04-20T03:58:21.755Z","creation":"2019-03-27T00:00:20Z"},"accession":"S-EPMC2977477","cross_references":{"pubmed":["21583627"],"doi":["10.1107/S1600536809028050"]}}