Geometry & MOs

Info

ID:	264755
PubChem CID:	103488752
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	283.141973
ΔH_f, kcal/mol:	-83.07
Dipole, Da:	5.88
IP(EA), eV:	-9.68(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxypropan-2-yl 2-amino-3-(3,4-dihydroxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOCC(C)OC1=C(C=CC(=C1)C#N)C(=O)C

DOS

IR

Vibrations