Geometry & MOs

Info

ID:

446382

PubChem CID:

135274568

Reduced:

O6H16C23 (1)

Stoich.:

A6B16C23 (1)

Weight, g/mol:

703.389139

ΔHf, kcal/mol:

-165.98

Dipole, Da:

4.88

IP(EA), eV:

 -9.47(-1.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(2-methylpropanoylamino)propyl 2-[2-[2-[4,4-dimethylpentanoyl-[2-[2-[2-[3-(2-methylpropanoylamino)propoxy]-2-oxoethoxy]acetyl]oxyethyl]amino]ethoxy]-2-oxoethoxy]acetate

Drug info:

PubChemData

Smile

CCC(=O)C1=CC2=C(C=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O

DOS

IR

Vibrations