Geometry & MOs

Info

ID:

354960

PubChem CID:

127287821

Reduced:

N3O3C14H23 (1)

Stoich.:

A3B3C14D23 (1)

Weight, g/mol:

333.14887

ΔHf, kcal/mol:

-149.12

Dipole, Da:

5.41

IP(EA), eV:

-9.48(0.29)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-fluoro-N-[1-[(2R)-5-oxopyrrolidine-2-carbonyl]piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CCN(CC1)C(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations