Geometry & MOs

Info

ID:

200434

PubChem CID:

79388639

Reduced:

N2O3C10H18 (1)

Stoich.:

A2B3C10D18 (1)

Weight, g/mol:

263.08254

ΔHf, kcal/mol:

-145.89

Dipole, Da:

4.78

IP(EA), eV:

-9.37(0.5)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(4-chloro-3-cyanophenyl)-2-methylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1C(CCN1)C(=O)N(C)CCC(=O)O

DOS

IR

Vibrations