Geometry & MOs

Info

ID:	263226
PubChem CID:	103347391
Reduced:	BrClN2S2C14H20 (1)
Stoich.:	ABC2D2E14F20 (1)
Weight, g/mol:	289.122655
ΔH_f, kcal/mol:	14.08
Dipole, Da:	4.18
IP(EA), eV:	-8.96(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-fluoro-3-[(6-methoxypyridin-2-yl)methylamino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1C(SC(CS1)C(CC2=C(C=C(C=C2)Br)Cl)NN)C

DOS

IR

Vibrations