Geometry & MOs

Info

ID:	139947
PubChem CID:	52620806
Reduced:	ON3C22H33 (1)
Stoich.:	AB3C22D33 (1)
Weight, g/mol:	372.220164
ΔH_f, kcal/mol:	-45.51
Dipole, Da:	1.17
IP(EA), eV:	-8.26(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]-2-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)CCCNC(=O)CCCC2=CNC3=CC=CC=C32)C

DOS

IR

Vibrations