Geometry & MOs

Info

ID:	53032
PubChem CID:	14709429
Reduced:	NOC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	267.219829
ΔH_f, kcal/mol:	-86.08
Dipole, Da:	4.27
IP(EA), eV:	-9.21(1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCCC1CCCCN1C(=O)C

DOS

IR

Vibrations