Geometry & MOs

Info

ID:	407274
PubChem CID:	135079725
Reduced:	SN2O2C6H10 (1)
Stoich.:	AB2C2D6E10 (1)
Weight, g/mol:	312.118401
ΔH_f, kcal/mol:	-36.45
Dipole, Da:	0.57
IP(EA), eV:	-8.92(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-2-(benzenesulfonyl)ethenyl]-2-[(E)-2-methylbut-2-enyl]benzene

Drug info:

PubChemData

Smile

CO/C(=C(/CCSC)\[N+]#N)/[O-]

DOS

IR

Vibrations