Geometry & MOs

Info

ID:	197948
PubChem CID:	79019750
Reduced:	O2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	296.137222
ΔH_f, kcal/mol:	-97.39
Dipole, Da:	4.59
IP(EA), eV:	-9.09(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxypyridin-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CC(C)CC(=O)O

DOS

IR

Vibrations