Geometry & MOs

Info

ID:	139858
PubChem CID:	52609290
Reduced:	N2O2C20H33 (1)
Stoich.:	A2B2C20D33 (1)
Weight, g/mol:	332.246378
ΔH_f, kcal/mol:	-80.31
Dipole, Da:	3.35
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754919
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCC[NH+]1CCNC(=O)COC2=CC(=C(C=C2)C(C)C)C

DOS

IR

Vibrations