Geometry & MOs

Info

ID:	148510
PubChem CID:	53788173
Reduced:	NO3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	169.146664
ΔH_f, kcal/mol:	-125.52
Dipole, Da:	3.7
IP(EA), eV:	-8.55(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-2-oxido-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridin-2-ium

Drug info:

PubChemData

Smile

CN1C(=O)CCC2=CC=CC=C21.COC.COC

DOS

IR

Vibrations