Geometry & MOs

Info

ID:	60853
PubChem CID:	26702639
Reduced:	SN2O7C18H22 (1)
Stoich.:	AB2C7D18E22 (1)
Weight, g/mol:	458.070321
ΔH_f, kcal/mol:	-223.33
Dipole, Da:	6.01
IP(EA), eV:	-8.48(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3-methylbenzoyl)amino]phenyl] 2-chloro-5-(methylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=CC(=C(C(=C2)OC)OC)OC)OC

DOS

IR

Vibrations