Geometry & MOs

Info

ID:	260088
PubChem CID:	103180909
Reduced:	BNF3O3C11H16 (1)
Stoich.:	ABC3D3E11F16 (1)
Weight, g/mol:	268.178693
ΔH_f, kcal/mol:	-313.11
Dipole, Da:	15.65
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.842780
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(3-methoxypropoxy)ethoxy]-6-methylpyridin-4-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

[B-](C1=CC(=CN=C1)OCCOCCCOC)(F)(F)F

DOS

IR

Vibrations