Geometry & MOs

Info

ID:	29185
PubChem CID:	832231
Reduced:	N2S2O5C11H16 (1)
Stoich.:	A2B2C5D11E16 (1)
Weight, g/mol:	320.050064
ΔH_f, kcal/mol:	-171.91
Dipole, Da:	3.27
IP(EA), eV:	-9.96(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[[(2S)-oxolan-2-yl]methyl]benzene-1,4-disulfonamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N

DOS

IR

Vibrations