Geometry & MOs

Info

ID:	188027
PubChem CID:	77655026
Reduced:	N2O2C8H9 (2)
Stoich.:	A2B2C8D9 (2)
Weight, g/mol:	334.142976
ΔH_f, kcal/mol:	-69.73
Dipole, Da:	8.19
IP(EA), eV:	-8.46(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[4-(dimethylamino)phenyl]-5-methyl-2,8-dihydro-[1,2,4]triazolo[4,3-a]quinoline-1,7-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=C2C=C(C=CC2N3C(=C1)N=NC3=O)OC

DOS

IR

Vibrations