Geometry & MOs

Info

ID:	211267
PubChem CID:	80922221
Reduced:	ON3C5H8 (2)
Stoich.:	AB3C5D8 (2)
Weight, g/mol:	293.026584
ΔH_f, kcal/mol:	-20.27
Dipole, Da:	2.74
IP(EA), eV:	-8.38(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1,3-thiazol-2-ylsulfanyl)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-yl]hydrazine

Drug info:

PubChemData

Smile

CC(CNC1=NC(=CN2C1=NC=C2)NN)(CO)O

DOS

IR

Vibrations