Geometry & MOs

Info

ID:

220936

PubChem CID:

85244542

Reduced:

N2O3H28C33 (1)

Stoich.:

A2B3C28D33 (1)

Weight, g/mol:

501.262105

ΔHf, kcal/mol:

-1.48

Dipole, Da:

2.47

IP(EA), eV:

 -9.32(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-1-hydroxy-3-methylbutan-2-yl]-1-[2-(methanesulfonamido)-3-methylbutanoyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CC(C(CC2=CC(=CC=C2)C#N)C(=O)O)NC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations