Geometry & MOs

Info

ID:	51235
PubChem CID:	12013875
Reduced:	OSH14C15 (1)
Stoich.:	ABC14D15 (1)
Weight, g/mol:	217.972377
ΔH_f, kcal/mol:	29.15
Dipole, Da:	2.49
IP(EA), eV:	-8.27(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dichloro-2-[(E)-2-methylsulfanylethenyl]benzene

Drug info:

PubChemData

Smile

CS/C=C/C1=CC=C(C=C1)OC2=CC=CC=C2

DOS

IR

Vibrations