Geometry & MOs

Info

ID:	50587
PubChem CID:	12013137
Reduced:	ON3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	239.105862
ΔH_f, kcal/mol:	42.34
Dipole, Da:	1.85
IP(EA), eV:	-8.52(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=NN3C=CC=C(C3=N2)C

DOS

IR

Vibrations