Geometry & MOs

Info

ID:	443006
PubChem CID:	135257361
Reduced:	O2N3C10H15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	168.126263
ΔH_f, kcal/mol:	-84.32
Dipole, Da:	2.96
IP(EA), eV:	-8.95(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2-methyl-2-azabicyclo[2.2.2]octane-5-carboxamide

Drug info:

PubChemData

Smile

CN1CC2CC(C1)C3(C2)C(=O)NC(=O)N3

DOS

IR

Vibrations