Geometry & MOs

Info

ID:	338257
PubChem CID:	127258949
Reduced:	ClON2C8H11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	350.9774
ΔH_f, kcal/mol:	-30.36
Dipole, Da:	3.73
IP(EA), eV:	-9.43(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-bromo-2-methylphenyl)-8-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanol

Drug info:

PubChemData

Smile

CN(C)C1=CC(=NC=C1)C=O.Cl

DOS

IR

Vibrations