Geometry & MOs

Info

ID:	298328
PubChem CID:	117648339
Reduced:	S2O3H18C22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	380.090472
ΔH_f, kcal/mol:	-14.77
Dipole, Da:	4.42
IP(EA), eV:	-9.06(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[3-methyl-4-[(E)-2-(4-prop-2-enoylsulfanylphenyl)ethenyl]phenyl] 2-methylprop-2-enethioate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations