Geometry & MOs

Info

ID:

214852

PubChem CID:

85083744

Reduced:

N3O7C36H37 (1)

Stoich.:

A3B7C36D37 (1)

Weight, g/mol:

623.312423

ΔHf, kcal/mol:

-107.06

Dipole, Da:

2.37

IP(EA), eV:

 -9.22(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1-bis(phenylmethoxy)phosphorylpropylamino]-N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]-4-methylpentanamide

Drug info:

PubChemData

Smile

COC1C(C(C(C(O1)C(C(=O)OCC2=CC=CC=C2)N=[N+]=[N-])OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

DOS

IR

Vibrations