Geometry & MOs

Info

ID:	77873
PubChem CID:	49666067
Reduced:	SF2O2N4H16C20 (1)
Stoich.:	AB2C2D4E16F20 (1)
Weight, g/mol:	392.130697
ΔH_f, kcal/mol:	-46.84
Dipole, Da:	3.98
IP(EA), eV:	-9.6(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-ethyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide

Drug info:

PubChemData

Smile

CC1=NN=C2N1C=C(C=C2)S(=O)(=O)N(CC3=CC(=CC(=C3)F)F)C4=CC=CC=C4

DOS

IR

Vibrations