{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["68(Pt 6)"],"submitter":["Fun HK"],"pubmed_abstract":["In the title compound, C(11)H(9)BrN(4)S, the 1,2,4-triazole ring is essentially planar (r.m.s. deviation = 0.020 Å) and makes a dihedral angle of 29.1 (5)° with the bromo-benzene ring. The 3,6-dihydro-1,3,4-thia-diazine ring adopts a twist-boat conformation. In the crystal, mol-ecules are linked by C-H⋯N inter-actions into sheets lying parallel to the (010) plane. The same N atom accepts two such hydrogen bonds."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1681"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC3379277"],"repository":["biostudies-literature"],"pubmed_title":["6-(4-Bromo-phen-yl)-3-methyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thia-diazine."],"pmcid":["PMC3379277"],"pubmed_authors":["Abdel-Aziz HA","Fun HK","Attia MI","Quah CK"],"additional_accession":[]},"is_claimable":false,"name":"6-(4-Bromo-phen-yl)-3-methyl-7H-1,2,4-triazolo[3,4-b][1,3,4]thia-diazine.","description":"In the title compound, C(11)H(9)BrN(4)S, the 1,2,4-triazole ring is essentially planar (r.m.s. deviation = 0.020 Å) and makes a dihedral angle of 29.1 (5)° with the bromo-benzene ring. The 3,6-dihydro-1,3,4-thia-diazine ring adopts a twist-boat conformation. In the crystal, mol-ecules are linked by C-H⋯N inter-actions into sheets lying parallel to the (010) plane. The same N atom accepts two such hydrogen bonds.","dates":{"release":"2012-01-01T00:00:00Z","publication":"2012 Jun","modification":"2025-04-05T12:59:40.788Z","creation":"2019-03-27T00:54:43Z"},"accession":"S-EPMC3379277","cross_references":{"pubmed":["22719475"],"doi":["10.1107/S1600536812019885"]}}