Geometry & MOs

Info

ID:	268830
PubChem CID:	103601139
Reduced:	ClOSC13H13 (1)
Stoich.:	ABCD13E13 (1)
Weight, g/mol:	216.037564
ΔH_f, kcal/mol:	-11.44
Dipole, Da:	3.69
IP(EA), eV:	-8.54(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-methyl-1-(2-methylsulfanylethoxy)benzene

Drug info:

PubChemData

Smile

CSCCOC1=CC=C(C2=CC=CC=C21)Cl

DOS

IR

Vibrations