Geometry & MOs

Info

ID:

432895

PubChem CID:

135173032

Reduced:

N4O9C26H30 (1)

Stoich.:

A4B9C26D30 (1)

Weight, g/mol:

423.236936

ΔHf, kcal/mol:

-356.95

Dipole, Da:

3.03

IP(EA), eV:

 -9.61(-0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-[[(2S)-1-[[(2S)-1,1-dihydroxy-4-methylpentan-2-yl]amino]-1-oxopropan-2-yl]-methylamino]-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N[C@@H](CC(=O)OCC1=CC=CC=C1)C(=O)NC(CC(=O)N)C(=O)O)NC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations