Geometry & MOs

Info

ID:	267401
PubChem CID:	103582112
Reduced:	BrNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	346.06808
ΔH_f, kcal/mol:	-57.63
Dipole, Da:	4.2
IP(EA), eV:	-8.2(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromo-3,5-dimethylanilino)-5,6,7,8-tetrahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NC2CCC(CC2)OC

DOS

IR

Vibrations