Geometry & MOs

Info

ID:	79021
PubChem CID:	49743134
Reduced:	FNOH7C9 (2)
Stoich.:	ABCD7E9 (2)
Weight, g/mol:	327.104148
ΔH_f, kcal/mol:	-134.73
Dipole, Da:	4.4
IP(EA), eV:	-8.95(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-2-oxo-1H-quinolin-7-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations