Geometry & MOs

Info

ID:	363992
PubChem CID:	127313661
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-20.75
Dipole, Da:	5.78
IP(EA), eV:	-9.7(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3-dimethylpiperidine-1-carbonyl)bicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC(C1)(C)C)N2C=NC=N2

DOS

IR

Vibrations