Geometry & MOs

Info

ID:	294039
PubChem CID:	117424269
Reduced:	FO4C14H17 (1)
Stoich.:	AB4C14D17 (1)
Weight, g/mol:	268.131074
ΔH_f, kcal/mol:	-199.85
Dipole, Da:	6.96
IP(EA), eV:	-9.01(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(5-ethyl-2,3-dimethoxyphenyl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1)OC)F)C2(CCCC2)C(=O)O

DOS

IR

Vibrations