Geometry & MOs

Info

ID:

1169

PubChem CID:

3903

Reduced:

N5O7C28H37 (1)

Stoich.:

A5B7C28D37 (1)

Weight, g/mol:

555.269299

ΔHf, kcal/mol:

-286.92

Dipole, Da:

4.4

IP(EA), eV:

 -9.2(-0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[2-[[2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=C(C=C2)O)N

DOS

IR

Vibrations