Geometry & MOs

Info

ID:	372778
PubChem CID:	131304569
Reduced:	INO3H8C10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	286.0117
ΔH_f, kcal/mol:	-46.17
Dipole, Da:	0.54
IP(EA), eV:	-9.64(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-bromo-6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=NC2=C(O1)C=CC(=C2)I

DOS

IR

Vibrations