Geometry & MOs

Info

ID:	310785
PubChem CID:	126587513
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	258.93995
ΔH_f, kcal/mol:	-81.8
Dipole, Da:	1.98
IP(EA), eV:	-8.67(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-7-chloro-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CN(C1=O)C)C2=CC3=C(C(=C2)CNC4CCCCC4)NC(=O)CC3

DOS

IR

Vibrations