Geometry & MOs

Info

ID:	158564
PubChem CID:	56464183
Reduced:	S2N3O6C19H21 (1)
Stoich.:	A2B3C6D19E21 (1)
Weight, g/mol:	445.074385
ΔH_f, kcal/mol:	-182.07
Dipole, Da:	4.63
IP(EA), eV:	-8.57(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[5-fluoro-2-(pyridine-2-carbonylamino)phenyl]sulfamoyl]-2-hydroxy-4-methylbenzoic acid

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=C(N=CC=C1)SCC(=O)NC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations