Geometry & MOs

Info

ID:	65107
PubChem CID:	29204479
Reduced:	F2S2O3N4C21H22 (1)
Stoich.:	A2B2C3D4E21F22 (1)
Weight, g/mol:	475.167811
ΔH_f, kcal/mol:	-151.73
Dipole, Da:	5.51
IP(EA), eV:	-9.43(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(diethylsulfamoyl)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C4=CC=CC=C4N=C3SC(F)F

DOS

IR

Vibrations