Geometry & MOs

Info

ID:	387853
PubChem CID:	134987136
Reduced:	ON4C8H10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	188.071154
ΔH_f, kcal/mol:	2.34
Dipole, Da:	4.02
IP(EA), eV:	-9.96(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-methylquinolizin-5-ium-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=C(C(=N1)N)C#N)CCO

DOS

IR

Vibrations