Geometry & MOs

Info

ID:	259690
PubChem CID:	103171942
Reduced:	ClN2O3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	241.095023
ΔH_f, kcal/mol:	-62.05
Dipole, Da:	2.48
IP(EA), eV:	-8.91(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,4-dimethoxypyridin-2-yl)methoxy]propanoic acid

Drug info:

PubChemData

Smile

COC1=C(C(=NC=C1)COC2=C(C=C(C=C2)CN)Cl)OC

DOS

IR

Vibrations