Geometry & MOs

Info

ID:	267922
PubChem CID:	103590357
Reduced:	FON3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	261.12774
ΔH_f, kcal/mol:	-41.7
Dipole, Da:	1.68
IP(EA), eV:	-8.18(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1-N-[(6-methoxypyridin-3-yl)methyl]-5-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NCC2=CC(=NC=C2)OC

DOS

IR

Vibrations