Geometry & MOs

Info

ID:

223769

PubChem CID:

85335547

Reduced:

N3O4C12H21 (2)

Stoich.:

A3B4C12D21 (2)

Weight, g/mol:

544.285677

ΔHf, kcal/mol:

-400.03

Dipole, Da:

3.15

IP(EA), eV:

 -9.87(0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-acetamido-5-[[1-[[1-[[2-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(CC(=O)N)C(=O)N1CCCC1C(=O)NC(C(C)CC)C(=O)NC(CO)C(=O)O)N

DOS

IR

Vibrations