Geometry & MOs

Info

ID:	73973
PubChem CID:	48421298
Reduced:	NO2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	321.097663
ΔH_f, kcal/mol:	-47.35
Dipole, Da:	3.03
IP(EA), eV:	-8.76(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[3-(trifluoromethyl)phenyl]methoxy]-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)NC2=C1C=C(C=C2)OCC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations