Geometry & MOs

Info

ID:	298335
PubChem CID:	117648366
Reduced:	FO2S2H15C21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	420.0654
ΔH_f, kcal/mol:	10.23
Dipole, Da:	1.37
IP(EA), eV:	-8.82(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=C)C(=O)SC1=CC(=C(C=C1)C#CC2=CC=C(C=C2)SC(=O)C=C)F

DOS

IR

Vibrations