Geometry & MOs

Info

ID:

201040

PubChem CID:

79479996

Reduced:

N2O5C14H22 (1)

Stoich.:

A2B5C14D22 (1)

Weight, g/mol:

298.262028

ΔHf, kcal/mol:

-178.14

Dipole, Da:

1.3

IP(EA), eV:

-8.63(0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 2-(cyclopropylamino)-5-[ethyl(2-methylbutyl)amino]-2-methylpentanoate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)CNC(=O)COCCN

DOS

IR

Vibrations