Geometry & MOs

Info

ID:	294056
PubChem CID:	117425560
Reduced:	ClN2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	268.097855
ΔH_f, kcal/mol:	-51.67
Dipole, Da:	4.46
IP(EA), eV:	-8.76(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-6-methoxy-2-pyrrolidin-2-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(C=C1CN3CCNCC3)Cl)OCO2

DOS

IR

Vibrations