Geometry & MOs

Info

ID:	140206
PubChem CID:	52663016
Reduced:	SF2O3N4C22H24 (1)
Stoich.:	AB2C3D4E22F24 (1)
Weight, g/mol:	444.16314
ΔH_f, kcal/mol:	-142.6
Dipole, Da:	9.34
IP(EA), eV:	-8.87(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(diethylsulfamoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)-3-fluorophenyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=C(C=C(C=C2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F)F)C

DOS

IR

Vibrations