Geometry & MOs

Info

ID:	404862
PubChem CID:	135071531
Reduced:	OS2H18C20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	356.051642
ΔH_f, kcal/mol:	55.11
Dipole, Da:	4.83
IP(EA), eV:	-8.32(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylsulfanyl-2-methylsulfinyl-1-phenylethenyl)-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CSC(=C(C1=CC=CC=C1)C2=CC3=CC=CC=C3C=C2)S(=O)C

DOS

IR

Vibrations