Geometry & MOs

Info

ID:	50593
PubChem CID:	12013144
Reduced:	N3O3C16H17 (1)
Stoich.:	A3B3C16D17 (1)
Weight, g/mol:	281.152812
ΔH_f, kcal/mol:	-19.18
Dipole, Da:	4.42
IP(EA), eV:	-8.01(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-butoxyphenyl)-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)OC)OC

DOS

IR

Vibrations