Geometry & MOs

Info

ID:	73940
PubChem CID:	48421230
Reduced:	FN2O3H15C19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	380.134777
ΔH_f, kcal/mol:	-64.33
Dipole, Da:	1.25
IP(EA), eV:	-8.73(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrrol-3-yl]-2-oxoethoxy]-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)NC2=C1C=C(C=C2)OCC3=CC(=NO3)C4=CC=C(C=C4)F

DOS

IR

Vibrations