Geometry & MOs

Info

ID:

349717

PubChem CID:

127275869

Reduced:

O3N4C20H30 (1)

Stoich.:

A3B4C20D30 (1)

Weight, g/mol:

375.172896

ΔHf, kcal/mol:

-81.97

Dipole, Da:

8.99

IP(EA), eV:

-8.95(-0.51)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-[1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)C2CCCN(C2)C(=O)C3CCCN(C3)C(=O)C4CC4

DOS

IR

Vibrations