Geometry & MOs

Info

ID:	197407
PubChem CID:	78963495
Reduced:	N2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	360.03347
ΔH_f, kcal/mol:	-92.26
Dipole, Da:	4.03
IP(EA), eV:	-8.82(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-(4-iodo-2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCN(CCN1C=CC=CC1=O)CC(C)(C)O

DOS

IR

Vibrations