Geometry & MOs

Info

ID:	182886
PubChem CID:	76949779
Reduced:	NOF3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	227.055798
ΔH_f, kcal/mol:	-172.02
Dipole, Da:	3.72
IP(EA), eV:	-9.6(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5,6,7-trifluoro-6H-quinolin-4-one

Drug info:

PubChemData

Smile

C1C2C(C(C(C1F)F)F)C(=O)CC(N2)C3=CC=CC=C3

DOS

IR

Vibrations