Geometry & MOs

Info

ID:	463
PubChem CID:	2796
Reduced:	ClO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	242.070972
ΔH_f, kcal/mol:	-128.6
Dipole, Da:	4.5
IP(EA), eV:	-8.96(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-chlorophenoxy)-2-methylpropanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl

DOS

IR

Vibrations