Geometry & MOs

Info

ID:	141572
PubChem CID:	52894968
Reduced:	SCl2N2O2H18C22 (1)
Stoich.:	AB2C2D2E18F22 (1)
Weight, g/mol:	449.05
ΔH_f, kcal/mol:	-35.65
Dipole, Da:	3.74
IP(EA), eV:	-8.67(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluorophenyl) 2-chloro-5-[(4-methoxyphenyl)-methylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=C(C=CC(=C3)Cl)Cl

DOS

IR

Vibrations