Geometry & MOs

Info

ID:	293578
PubChem CID:	117393866
Reduced:	SO5C11H12 (1)
Stoich.:	AB5C11D12 (1)
Weight, g/mol:	256.040545
ΔH_f, kcal/mol:	-175.22
Dipole, Da:	6.54
IP(EA), eV:	-9.37(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylsulfonyl-1,3-benzodioxol-5-yl)cyclopropan-1-ol

Drug info:

PubChemData

Smile

CC(=O)CC1=CC2=C(C=C1S(=O)(=O)C)OCO2

DOS

IR

Vibrations