Geometry & MOs

Info

ID:	287304
PubChem CID:	104234348
Reduced:	NOF3C10H12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	260.132491
ΔH_f, kcal/mol:	-172.79
Dipole, Da:	3.81
IP(EA), eV:	-9.41(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-(pyridin-4-ylmethoxy)phenyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC(F)F)F)NC

DOS

IR

Vibrations