Geometry & MOs

Info

ID:	341089
PubChem CID:	127263524
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	121.029442
ΔH_f, kcal/mol:	-60.91
Dipole, Da:	1.65
IP(EA), eV:	-8.86(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylazetidin-3-one;hydrochloride

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)OCCN)OC=C2.Cl

DOS

IR

Vibrations