Geometry & MOs

Info

ID:	49216
PubChem CID:	11531950
Reduced:	SO3N4C21H36 (1)
Stoich.:	AB3C4D21E36 (1)
Weight, g/mol:	424.082599
ΔH_f, kcal/mol:	-152.48
Dipole, Da:	8.07
IP(EA), eV:	-9.8(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-[[2-(4-chlorophenoxy)acetyl]amino]benzoyl]amino]benzoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCNC(=O)N/C(=N/S(=O)(=O)C1=CC=C(C=C1)C)/N

DOS

IR

Vibrations