Geometry & MOs

Info

ID:	362046
PubChem CID:	127305583
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	251.163377
ΔH_f, kcal/mol:	-1.37
Dipole, Da:	4.8
IP(EA), eV:	-8.86(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(1-azabicyclo[2.2.2]octan-3-yl)-N-methyl-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NOC2=C1C=C(C=N2)C(=O)N(C)C3CN4CCC3CC4

DOS

IR

Vibrations