Geometry & MOs

Info

ID:	401294
PubChem CID:	135050833
Reduced:	ON2C14H14 (1)
Stoich.:	AB2C14D14 (1)
Weight, g/mol:	387.98394
ΔH_f, kcal/mol:	14.37
Dipole, Da:	4.47
IP(EA), eV:	-8.54(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(1-methylpyridin-1-ium-4-yl)methyl]benzamide;iodide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)O)N=C(C2=CC=CC=C2)N

DOS

IR

Vibrations