N4-[4-(2,4-Dimethylthiazol-3-Ium-5-Id-5-Yl)-5H-Pyrimidine-1,3-Diium-5-Id-2-Yl]-N1,N1-Dimethyl-2-Nitro-Benzene-1,4-Diamine

Molecule SVG Image

Properties Simple | Detailed

Formula C17H18N6O2S
IUPAC Name n4-[4-(2,4-dimethylthiazol-3-ium-5-id-5-yl)-5h-pyrimidine-1,3-diium-5-id-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 7.07 ± 1.08 D
Volume 420.25 Å 3
Surface Area 379.14 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 1.71 ± eV
Point Group Symmetry C1
InChIKey QWFWVJMQSBWNAB-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N