Geometry & MOs

Info

ID:	431095
PubChem CID:	135171165
Reduced:	FN4H7C8 (1)
Stoich.:	AB4C7D8 (1)
Weight, g/mol:	255.97599
ΔH_f, kcal/mol:	43.29
Dipole, Da:	3.76
IP(EA), eV:	-8.8(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-(3-fluoropyridin-2-yl)pyrazol-3-amine

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)N2C(=CC=N2)N)F

DOS

IR

Vibrations