Geometry & MOs

Info

ID:	24570
PubChem CID:	611191
Reduced:	BrN3H6C7 (1)
Stoich.:	AB3C6D7 (1)
Weight, g/mol:	210.97451
ΔH_f, kcal/mol:	70.97
Dipole, Da:	1.02
IP(EA), eV:	-9.6(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-methyl-[1,2,4]triazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

CC1=NN2C=C(C=CC2=N1)Br

DOS

IR

Vibrations