Geometry & MOs

Info

ID:	338446
PubChem CID:	127259138
Reduced:	SO2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	294.056195
ΔH_f, kcal/mol:	-106.18
Dipole, Da:	6.27
IP(EA), eV:	-8.84(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[furan-2-yl-(4-methylphenyl)sulfonylmethyl] acetate

Drug info:

PubChemData

Smile

CCCCC#CCSC1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)C)OC(=O)C

DOS

IR

Vibrations