Geometry & MOs

Info

ID:	60431
PubChem CID:	26686020
Reduced:	O2N3C24H34 (1)
Stoich.:	A2B3C24D34 (1)
Weight, g/mol:	395.257277
ΔH_f, kcal/mol:	-31.18
Dipole, Da:	5.19
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.795994
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methoxyphenyl)ethyl]-2-[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC(=O)NCCC3=CC=C(C=C3)OC

DOS

IR

Vibrations