Geometry & MOs

Info

ID:	140598
PubChem CID:	52728856
Reduced:	N2O3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	370.225643
ΔH_f, kcal/mol:	-81.57
Dipole, Da:	4.9
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.089742
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethoxypiperidin-1-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCOC1CC[NH+](CC1)CC(=O)N(C)CC2=CC3=C(C=C2)C=C(C=C3)OC

DOS

IR

Vibrations