Geometry & MOs

Info

ID:	137185
PubChem CID:	52167507
Reduced:	ON3C8H10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	342.180424
ΔH_f, kcal/mol:	-10.07
Dipole, Da:	5.07
IP(EA), eV:	-8.87(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-diethyl-6-[(1-propylbenzimidazol-2-yl)amino]-1,2,4-triazine-3,5-dione

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1NC3=NN(C(=O)N(C3=O)CC)CC

DOS

IR

Vibrations