Geometry & MOs

Info

ID:	124723
PubChem CID:	50893990
Reduced:	ClSN2O6C10H11 (1)
Stoich.:	ABC2D6E10F11 (1)
Weight, g/mol:	369.103479
ΔH_f, kcal/mol:	-144.21
Dipole, Da:	11.73
IP(EA), eV:	-9.9(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[benzenesulfonyl(naphthalen-1-yl)amino]butanoic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)Cl)S(=O)(=O)C

DOS

IR

Vibrations