Geometry & MOs

Info

ID:	203150
PubChem CID:	79785383
Reduced:	ION3C5H8 (1)
Stoich.:	ABC3D5E8 (1)
Weight, g/mol:	368.98375
ΔH_f, kcal/mol:	35.33
Dipole, Da:	3.83
IP(EA), eV:	-9.73(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-iodo-1-(3,3,3-trifluoropropyl)-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

COCCN1C=NC(=N1)I

DOS

IR

Vibrations