Geometry & MOs

Info

ID:	9024
PubChem CID:	85200
Reduced:	Cl2O3C10H10 (1)
Stoich.:	A2B3C10D10 (1)
Weight, g/mol:	248.0007
ΔH_f, kcal/mol:	-123.26
Dipole, Da:	1.35
IP(EA), eV:	-9.39(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3,5-dichloro-4-methoxybenzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C(=C1)Cl)OC)Cl

DOS

IR

Vibrations