Geometry & MOs

Info

ID:	143361
PubChem CID:	53196994
Reduced:	OF2N4H14C20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	330.129217
ΔH_f, kcal/mol:	-8.98
Dipole, Da:	4.98
IP(EA), eV:	-9.59(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-3-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)C2=CC3=NN=C(N3C=C2)C4=CC(=CC(=C4)F)F

DOS

IR

Vibrations