Geometry & MOs

Info

ID:

179570

PubChem CID:

76501518

Reduced:

N3O4C18H26 (2)

Stoich.:

A3B4C18D26 (2)

Weight, g/mol:

451.255971

ΔHf, kcal/mol:

-358.86

Dipole, Da:

9.72

IP(EA), eV:

 -8.6(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[[1-[[2-[[5-amino-6-(methylamino)-6-oxohexyl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]propylphosphonic acid

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C1CN(CCN1C(C(CCC2=CC=CC=C2)O)N(C(=O)C(CC(=O)N)N)C(=O)OCC3=CC=CC=C3)C(=O)OC(C)(C)C

DOS

IR

Vibrations