Geometry & MOs

Info

ID:	298330
PubChem CID:	117648350
Reduced:	OSH8C10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	438.095952
ΔH_f, kcal/mol:	24.0
Dipole, Da:	0.72
IP(EA), eV:	-8.82(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-methylprop-2-enoylsulfanyl)phenyl] (E)-2-methyl-3-(4-prop-2-enoylsulfanylphenyl)but-2-enoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations