Geometry & MOs

Info

ID:	362053
PubChem CID:	127305590
Reduced:	ON2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	329.177313
ΔH_f, kcal/mol:	1.61
Dipole, Da:	5.81
IP(EA), eV:	-9.08(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-N-methyl-1-methylsulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC2=C1C=C(C=N2)C(=O)N(C)C3CN4CCC3CC4

DOS

IR

Vibrations