Geometry & MOs

Info

ID:

45021

PubChem CID:

10507259

Reduced:

NPO7C31H40 (1)

Stoich.:

ABC7D31E40 (1)

Weight, g/mol:

569.284949

ΔHf, kcal/mol:

-347.44

Dipole, Da:

5.64

IP(EA), eV:

 -9.5(0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-4-amino-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC(NC(=O)OCC1=CC=CC=C1)P(=O)(CC(COCC2=CC=CC=C2)C(=O)O)OC34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations