Geometry & MOs

Info

ID:	49192
PubChem CID:	11528896
Reduced:	SO3H12C13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	248.162374
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	5.9
IP(EA), eV:	-9.62(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxy-3-[4-(oxiran-2-ylmethoxy)butoxy]propan-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CS(=O)(=O)/C=C/C2=CC=CO2

DOS

IR

Vibrations