Geometry & MOs

Info

ID:	341198
PubChem CID:	127263633
Reduced:	BrFNOH3C5 (1)
Stoich.:	ABCDE3F5 (1)
Weight, g/mol:	325.99161
ΔH_f, kcal/mol:	-62.84
Dipole, Da:	4.96
IP(EA), eV:	-9.55(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-2-phenylmethoxypyridin-4-amine

Drug info:

PubChemData

Smile

C1=CNC(=O)C(=C1F)Br

DOS

IR

Vibrations