Geometry & MOs

Info

ID:	339424
PubChem CID:	127261320
Reduced:	SO3C11H12 (1)
Stoich.:	AB3C11D12 (1)
Weight, g/mol:	270.071451
ΔH_f, kcal/mol:	-87.72
Dipole, Da:	4.8
IP(EA), eV:	-10.13(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(E)-2-(benzenesulfinyl)ethenyl]phenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)/C=C/S(=O)(=O)C

DOS

IR

Vibrations