Geometry & MOs

Info

ID:

250115

PubChem CID:

103094271

Reduced:

ClON3C13H18 (1)

Stoich.:

ABC3D13E18 (1)

Weight, g/mol:

239.08254

ΔHf, kcal/mol:

-29.6

Dipole, Da:

3.26

IP(EA), eV:

-9.1(-0.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(3-chloropyridin-2-yl)-3-methylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1(CCNCC1)C(=O)NC2=C(C=CC=N2)Cl

DOS

IR

Vibrations