Geometry & MOs

Info

ID:	341049
PubChem CID:	127263484
Reduced:	BrFN3H7C10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	21.02
Dipole, Da:	2.15
IP(EA), eV:	-9.3(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-1,4-dimethyl-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=NC(=NC=C2Br)N)F

DOS

IR

Vibrations