Geometry & MOs

Info

ID:	298282
PubChem CID:	117648222
Reduced:	FO2S2H17C20 (1)
Stoich.:	AB2C2D17E20 (1)
Weight, g/mol:	408.046557
ΔH_f, kcal/mol:	-56.06
Dipole, Da:	2.12
IP(EA), eV:	-9.09(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[4-[2,3-difluoro-4-(2-methylprop-2-enoylsulfanyl)phenyl]-2-fluorophenyl] 2-methylprop-2-enethioate

Drug info:

PubChemData

Smile

CC(=C)C(=O)SC1=CC=C(C=C1)C2=CC(=C(C=C2)SC(=O)C(=C)C)F

DOS

IR

Vibrations