Geometry & MOs

Info

ID:	427894
PubChem CID:	135165018
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	322.334799
ΔH_f, kcal/mol:	-72.44
Dipole, Da:	2.47
IP(EA), eV:	-8.71(2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-1-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]piperidine

Drug info:

PubChemData

Smile

CC(C)(C)CN1CC(C1)OCC(C)(C)C

DOS

IR

Vibrations