Geometry & MOs

Info

ID:	199571
PubChem CID:	79267485
Reduced:	BrON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	274.148141
ΔH_f, kcal/mol:	14.07
Dipole, Da:	1.76
IP(EA), eV:	-9.27(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-fluoro-2-[(6-methylpyridin-2-yl)methoxy]phenyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)COC2=C(C=CC=C2Br)CN

DOS

IR

Vibrations