Geometry & MOs

Info

ID:

219939

PubChem CID:

85165067

Reduced:

NO8C36H45 (1)

Stoich.:

AB8C36D45 (1)

Weight, g/mol:

619.438049

ΔHf, kcal/mol:

-329.98

Dipole, Da:

2.76

IP(EA), eV:

 -8.55(-0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[[2-[(3-amino-2-methyldecanoyl)amino]-3-methylbutanoyl]-methylamino]-3-[tert-butyl(dimethyl)silyl]oxy-5-phenylpentanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OCC2=CC=CC=C2)C)C(C)(C)CCOC(=O)C(CC(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations