Geometry & MOs

Info

ID:	17762
PubChem CID:	517727
Reduced:	Cl3O3C12H13 (1)
Stoich.:	A3B3C12D13 (1)
Weight, g/mol:	309.993027
ΔH_f, kcal/mol:	-140.83
Dipole, Da:	4.52
IP(EA), eV:	-8.85(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenoxy)ethyl 2,2-dichloropropanoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OCCOC(=O)C(C)(Cl)Cl

DOS

IR

Vibrations