Geometry & MOs

Info

ID:	298293
PubChem CID:	117648249
Reduced:	OSF2H5C9 (2)
Stoich.:	ABC2D5E9 (2)
Weight, g/mol:	394.030907
ΔH_f, kcal/mol:	-168.02
Dipole, Da:	3.6
IP(EA), eV:	-9.36(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[2,3-difluoro-4-(3-fluoro-4-prop-2-enoylsulfanylphenyl)phenyl] 2-methylprop-2-enethioate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations