Geometry & MOs

Info

ID:	50588
PubChem CID:	12013138
Reduced:	ON3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	243.056325
ΔH_f, kcal/mol:	49.3
Dipole, Da:	2.31
IP(EA), eV:	-8.58(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC(=N2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations