Geometry & MOs

Info

ID:	184787
PubChem CID:	77207039
Reduced:	NO11C28H43 (1)
Stoich.:	AB11C28D43 (1)
Weight, g/mol:	483.210446
ΔH_f, kcal/mol:	-502.61
Dipole, Da:	6.08
IP(EA), eV:	-9.57(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3,4-bis(ethoxycarbonyloxy)phenyl]-2-[2-(2,2-dimethylpropanoyloxy)propylamino]propanoic acid

Drug info:

PubChemData

Smile

CCCOC(=O)OC(C)CC(CC1=CC(=C(C=C1)OC(=O)OCCC(C)C)OC(=O)OCCC(C)C)(C(=O)O)N

DOS

IR

Vibrations