Geometry & MOs

Info

ID:	225138
PubChem CID:	85741931
Reduced:	N2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	292.99128
ΔH_f, kcal/mol:	63.99
Dipole, Da:	5.13
IP(EA), eV:	-10.27(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methylpyridin-1-ium-1-yl)propanoic acid;iodide

Drug info:

PubChemData

Smile

CC=CC(C#N)(C#N)C(CC=C)C(C)C

DOS

IR

Vibrations