Geometry & MOs

Info

ID:	143404
PubChem CID:	53203948
Reduced:	FON2C9H10 (2)
Stoich.:	ABC2D9E10 (2)
Weight, g/mol:	282.111676
ΔH_f, kcal/mol:	-129.05
Dipole, Da:	4.99
IP(EA), eV:	-9.22(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CN1C(=O)C=C(C=N1)N2CCCC(C2)C(=O)NCC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations