Geometry & MOs

Info

ID:	324137
PubChem CID:	126677000
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	302.235814
ΔH_f, kcal/mol:	-120.85
Dipole, Da:	3.22
IP(EA), eV:	-8.85(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4R)-1-[(4-methoxyphenyl)methyl]-2-methyl-4-piperidin-4-ylpiperidine

Drug info:

PubChemData

Smile

C[C@@H]1[C@H]([C@@H](CCN1)C2=CC(=CC=C2)OCCOC)COC3=CC4=C(CNC4=O)C=C3

DOS

IR

Vibrations