Geometry & MOs

Info

ID:

238959

PubChem CID:

93165781

Reduced:

NF2O4H15C17 (1)

Stoich.:

AB2C4D15E17 (1)

Weight, g/mol:

348.204907

ΔHf, kcal/mol:

-215.0

Dipole, Da:

4.43

IP(EA), eV:

-8.82(-0.82)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3R)-N-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1[C@@H](OC2=CC=CC=C2O1)CNC(=O)C3=CC=CC=C3OC(F)F

DOS

IR

Vibrations