Geometry & MOs

Info

ID:	254391
PubChem CID:	103124960
Reduced:	BrOSN3H6C11 (1)
Stoich.:	ABCD3E6F11 (1)
Weight, g/mol:	317.9804
ΔH_f, kcal/mol:	82.51
Dipole, Da:	3.05
IP(EA), eV:	-9.53(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-fluorophenyl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

C1=CN2C(=C(C=N2)C(=O)C3=CSC=C3Br)C=N1

DOS

IR

Vibrations