Geometry & MOs

Info

ID:

32784

PubChem CID:

7848315

Reduced:

N2O3C15H18 (1)

Stoich.:

A2B3C15D18 (1)

Weight, g/mol:

279.147058

ΔHf, kcal/mol:

-99.1

Dipole, Da:

3.59

IP(EA), eV:

-9.36(-0.77)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[2-(4-methoxyanilino)-2-oxoethyl] 4-methylpentanoate

Drug info:

PubChemData

Smile

CC(C)CCC(=O)OCC(=O)NC1=CC=CC=C1C#N

DOS

IR

Vibrations