Geometry & MOs

Info

ID:	413738
PubChem CID:	135086688
Reduced:	SO2C19H22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	272.087101
ΔH_f, kcal/mol:	-44.1
Dipole, Da:	6.4
IP(EA), eV:	-9.56(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-2-phenylprop-1-enyl]sulfonylmethylbenzene

Drug info:

PubChemData

Smile

CCCC/C(=C\S(=O)(=O)CC1=CC=CC=C1)/C2=CC=CC=C2

DOS

IR

Vibrations