Geometry & MOs

Info

ID:	78909
PubChem CID:	49742691
Reduced:	ON3H9C10 (2)
Stoich.:	AB3C9D10 (2)
Weight, g/mol:	392.130697
ΔH_f, kcal/mol:	41.78
Dipole, Da:	4.0
IP(EA), eV:	-9.09(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

DOS

IR

Vibrations