Geometry & MOs

Info

ID:	124737
PubChem CID:	50894506
Reduced:	NSO5C11H17 (1)
Stoich.:	ABC5D11E17 (1)
Weight, g/mol:	369.007386
ΔH_f, kcal/mol:	-194.39
Dipole, Da:	4.84
IP(EA), eV:	-9.46(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[benzenesulfonyl(carboxymethyl)amino]-2-chlorobenzoic acid

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN(CC1=CC=CO1)S(=O)(=O)C

DOS

IR

Vibrations