Geometry & MOs

Info

ID:	50590
PubChem CID:	12013140
Reduced:	ON3H17C20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	239.105862
ΔH_f, kcal/mol:	77.0
Dipole, Da:	1.85
IP(EA), eV:	-8.55(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxyphenyl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations