N~4~-[4-(2,4-Dimethyl-1,3-Thiazol-5-Yl)-2-Pyrimidinyl]-N~1~,N~1~-Dimethyl-2-Nitro-1,4-Benzenediamine

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Formula C17H18N6O2S
IUPAC Name n4-[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]-n1,n1-dimethyl-2-nitro-benzene-1,4-diamine
Molecular Mass 370.429 g·mol−1
Heat of Formation 354.1 ± 16.7 kJ·mol−1
Dipole Moment 7.04 ± 1.08 D
Volume 420.02 Å 3
Surface Area 378.77 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 1.70 ± eV
Point Group Symmetry C1
Synonyms
  • [4-[[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]amino]-2-nitro-phenyl]-dimethyl-amine
  • n'-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-n,n-dimethyl-2-nitro-benzene-1,4-diamine
  • n'-[4-(2,4-dimethyl-5-thiazolyl)-2-pyrimidinyl]-n,n-dimethyl-2-nitrobenzene-1,4-diamine
  • n'-[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]-n,n-dimethyl-2-nitro-benzene-1,4-diamine
InChIKey MYHBMTAGTIOCHM-UHFFFAOYSA-N
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