Geometry & MOs

Info

ID:	254252
PubChem CID:	103123716
Reduced:	ON6C11H12 (1)
Stoich.:	AB6C11D12 (1)
Weight, g/mol:	227.117095
ΔH_f, kcal/mol:	88.77
Dipole, Da:	5.76
IP(EA), eV:	-9.11(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-propan-2-yl-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

COCCN1C=NN=C1C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations