2-(4-Aminobenzenesulfonamido)-4,6-dimetylpyrimidin-1-ium 2-carboxy-4,6-dinitrophenolate
Data(s) |
01/04/2013
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Resumo |
In the structure of the of the phenolate salt of the sulfa drug sulfamethazine with 3,5-dinitrosalicylic acid, C12H15N4O2S+ C7H3N2O7-, the dihedral angle between the pyrimidine and phenyl rings of the cation is 59.70(17)\%. Cation--anion hydrogen-bonding interactions involving pyrimidine N+-H...O(carboxyl) and amine N-H...O(carboxyl) pairs give a cyclic R2/2(8) motif while secondary N-H...O hydrogen bonds between the aniline group and both sulfone and nitro O-atom acceptors give a two-dimensional structure extending along (001). |
Identificador | |
Publicador |
Blackwell Publishing on behalf of IUCr |
Relação |
DOI:10.1107/S1600536813005631 Smith, Graham & Wermuth, Urs D. (2013) 2-(4-Aminobenzenesulfonamido)-4,6-dimetylpyrimidin-1-ium 2-carboxy-4,6-dinitrophenolate. Acta Crystallographica. Section E: Structure Reports Online, 69(4), o472-o472. |
Fonte |
School of Chemistry, Physics & Mechanical Engineering; Science & Engineering Faculty |
Palavras-Chave | #sulfamethazine #3,5-dinitrosalicylic acid #proton transfer #crystal structure #hydrogen bonding |
Tipo |
Journal Article |