Geometry & MOs

Info

ID:	204525
PubChem CID:	79977357
Reduced:	BrC11H13 (1)
Stoich.:	AB11C13 (1)
Weight, g/mol:	364.0245
ΔH_f, kcal/mol:	24.94
Dipole, Da:	2.0
IP(EA), eV:	-9.47(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[amino-(5-bromo-4-methylthiophen-2-yl)methyl]-1-methyl-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

C1CC1C2=CC=CC(=C2)CCBr

DOS

IR

Vibrations