Geometry & MOs

Info

ID:	246998
PubChem CID:	103066215
Reduced:	ClOF6C7H7 (1)
Stoich.:	ABC6D7E7 (1)
Weight, g/mol:	228.037564
ΔH_f, kcal/mol:	-360.08
Dipole, Da:	3.34
IP(EA), eV:	-10.94(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(chloromethyl)prop-2-enylsulfanyl]-4-methoxybenzene

Drug info:

PubChemData

Smile

C=C(COC(C(F)(F)F)C(F)(F)F)CCl

DOS

IR

Vibrations