Geometry & MOs

Info

ID:	411446
PubChem CID:	135084277
Reduced:	ClC13H17 (1)
Stoich.:	AB13C17 (1)
Weight, g/mol:	233.996283
ΔH_f, kcal/mol:	-5.37
Dipole, Da:	1.73
IP(EA), eV:	-9.29(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dichloro-7-hydroxy-1-methyl-6,7-dihydro-5H-pyrrolo[3,2-c]pyridin-4-one

Drug info:

PubChemData

Smile

CC/C(=C(/CC)\Cl)/CC1=CC=CC=C1

DOS

IR

Vibrations