Geometry & MOs

Info

ID:	245142
PubChem CID:	99437695
Reduced:	SO3N5H17C20 (1)
Stoich.:	AB3C5D17E20 (1)
Weight, g/mol:	481.122003
ΔH_f, kcal/mol:	12.19
Dipole, Da:	7.83
IP(EA), eV:	-9.21(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]-N-(5-fluoropyridin-2-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC3=CC(=CC=C3)N4C(=NN=N4)SC

DOS

IR

Vibrations