Geometry & MOs

Info

ID:

354863

PubChem CID:

127287623

Reduced:

O2N4C15H26 (1)

Stoich.:

A2B4C15D26 (1)

Weight, g/mol:

309.18009

ΔHf, kcal/mol:

-57.92

Dipole, Da:

5.73

IP(EA), eV:

-9.18(0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(4-acetylpiperazin-1-yl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-ylamino]ethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NCC(=O)N(C)C2CCCCC2

DOS

IR

Vibrations