Geometry & MOs

Info

ID:	228627
PubChem CID:	87565445
Reduced:	NC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	207.02588
ΔH_f, kcal/mol:	94.65
Dipole, Da:	0.71
IP(EA), eV:	-8.76(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylpiperidin-1-ium-4-one;bromide

Drug info:

PubChemData

Smile

CC(C1=CC=CC2=CC=CC=C21)C(/C=C/C#CCN)N

DOS

IR

Vibrations