Geometry & MOs

Info

ID:	32156
PubChem CID:	4266414
Reduced:	SO2Cl3N4H33C35 (1)
Stoich.:	AB2C3D4E33F35 (1)
Weight, g/mol:	254.012319
ΔH_f, kcal/mol:	23.43
Dipole, Da:	4.62
IP(EA), eV:	-8.19(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

4-(2,5-dioxopyrrolidin-1-yl)benzenesulfonate

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)CC2C(=NN(C23N(C(=O)CS3)C4=CC=C(C=C4)OC5=C(C=C(C=C5)Cl)Cl)C6=CC=CC=C6Cl)C

DOS

IR

Vibrations