Geometry & MOs

Info

ID:	36583
PubChem CID:	8009170
Reduced:	N2F3O3C8H9 (1)
Stoich.:	A2B3C3D8E9 (1)
Weight, g/mol:	270.160637
ΔH_f, kcal/mol:	-265.44
Dipole, Da:	3.12
IP(EA), eV:	-10.04(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[methyl-(1-methylpyridin-1-ium-2-yl)amino]-N-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1[C@](CC(=O)O)(C(F)(F)F)O

DOS

IR

Vibrations