Geometry & MOs

Info

ID:	388289
PubChem CID:	134988699
Reduced:	ClSC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	291.964705
ΔH_f, kcal/mol:	0.75
Dipole, Da:	2.79
IP(EA), eV:	-8.43(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-4-(1,2,2-trichloroethenylsulfanyl)but-2-en-2-yl]benzene

Drug info:

PubChemData

Smile

CCCC(=C(SC1=CC=CC=C1)Cl)CCC

DOS

IR

Vibrations