{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["71(Pt 6)"],"submitter":["Kang G"],"pubmed_abstract":["The title compound, C12H18N4O6S (systematic name: 4-di-propyl-amino-3,5-di-nitro-benzene-sulfonamide), is a sulfonamide with herbicidal properties marketed as oryzalin. The dihedral angles between the benzene ring and the mean planes of the nitro groups are 26.15 (11) and 54.80 (9)°. The propyl arms of the di-propyl-amino substituent lie on opposite sides of this ring plane. In the crystal, N-H⋯O and C-H⋯O hydrogen bonds generate a three-dimensional network."],"journal":["Acta crystallographica. Section E, Crystallographic communications"],"pagination":["o429"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC4459385"],"repository":["biostudies-literature"],"pubmed_title":["Crystal structure of oryzalin."],"pmcid":["PMC4459385"],"pubmed_authors":["Kim TH","Kang G","Jeon Y","Kim J"],"additional_accession":[]},"is_claimable":false,"name":"Crystal structure of oryzalin.","description":"The title compound, C12H18N4O6S (systematic name: 4-di-propyl-amino-3,5-di-nitro-benzene-sulfonamide), is a sulfonamide with herbicidal properties marketed as oryzalin. The dihedral angles between the benzene ring and the mean planes of the nitro groups are 26.15 (11) and 54.80 (9)°. The propyl arms of the di-propyl-amino substituent lie on opposite sides of this ring plane. In the crystal, N-H⋯O and C-H⋯O hydrogen bonds generate a three-dimensional network.","dates":{"release":"2015-01-01T00:00:00Z","publication":"2015 Jun","modification":"2025-04-18T22:13:09.925Z","creation":"2019-03-27T01:53:02Z"},"accession":"S-EPMC4459385","cross_references":{"pubmed":["26090208"],"doi":["10.1107/S205698901500955X"]}}