Geometry & MOs

Info

ID:	254034
PubChem CID:	103122331
Reduced:	O2N5C10H13 (1)
Stoich.:	A2B5C10D13 (1)
Weight, g/mol:	271.106925
ΔH_f, kcal/mol:	8.85
Dipole, Da:	7.44
IP(EA), eV:	-9.39(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-methyl-5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-triazole-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=NN(C(=N1)C2=NN(C=C2)C)C

DOS

IR

Vibrations