Geometry & MOs

Info

ID:	298302
PubChem CID:	117648265
Reduced:	O2S2F3H11C18 (1)
Stoich.:	A2B2C3D11E18 (1)
Weight, g/mol:	354.074822
ΔH_f, kcal/mol:	-129.73
Dipole, Da:	3.1
IP(EA), eV:	-9.44(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[2-methyl-4-(4-prop-2-enoylsulfanylphenyl)phenyl] 2-methylprop-2-enethioate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations