Geometry & MOs

Info

ID:	323338
PubChem CID:	126674354
Reduced:	F2N4H10C13 (1)
Stoich.:	A2B4C10D13 (1)
Weight, g/mol:	356.97246
ΔH_f, kcal/mol:	-1.55
Dipole, Da:	4.15
IP(EA), eV:	-9.03(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridine

Drug info:

PubChemData

Smile

C1=CN2C(=NC(=N2)N)C(=C1)C3=CC=C(C=C3)C(F)F

DOS

IR

Vibrations