Geometry & MOs

Info

ID:	144733
PubChem CID:	53404121
Reduced:	ClN3C10H10 (1)
Stoich.:	AB3C10D10 (1)
Weight, g/mol:	447.9245
ΔH_f, kcal/mol:	48.19
Dipole, Da:	2.61
IP(EA), eV:	-8.75(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CN1C=C(N=C1N)C2=CC=CC=C2Cl

DOS

IR

Vibrations