Geometry & MOs

Info

ID:	10716
PubChem CID:	107090
Reduced:	NSO6C8H11 (1)
Stoich.:	ABC6D8E11 (1)
Weight, g/mol:	249.030708
ΔH_f, kcal/mol:	-213.95
Dipole, Da:	8.99
IP(EA), eV:	-9.15(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

azane;1,3-benzodioxol-5-yl(hydroxy)methanesulfonic acid

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C(O)S(=O)(=O)O.N

DOS

IR

Vibrations