Geometry & MOs

Info

ID:	276932
PubChem CID:	103825850
Reduced:	BrFN2O2H14C15 (1)
Stoich.:	ABC2D2E14F15 (1)
Weight, g/mol:	266.062219
ΔH_f, kcal/mol:	-58.46
Dipole, Da:	7.64
IP(EA), eV:	-8.77(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloro-2-methoxyphenyl)methyl]-6-fluoropyridin-3-amine

Drug info:

PubChemData

Smile

C1COC2=C(C(=CC(=C2)CNC3=CN=C(C=C3)F)Br)OC1

DOS

IR

Vibrations