Formula |
C19H21N5OS |
IUPAC Name |
n-[4-[6-(isopropylamino)-5h-pyrimidine-1,3-diium-5-id-4-yl]-5h-thiazol-3-ium-5-id-2-yl]-n,4-dimethyl-benzamide |
Molecular Mass |
367.468 g·mol−1 |
Heat of Formation |
147.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.06 ± 1.08 D |
Volume |
441.94 Å 3 |
Surface Area |
359.9 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-1.26 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YWMSMVNZMJXUKI-UHFFFAOYSA-N |
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Elements |
H
S
C
O
N
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