Geometry & MOs

Info

ID:	124225
PubChem CID:	50875391
Reduced:	S2N3O3C21H33 (1)
Stoich.:	A2B3C3D21E33 (1)
Weight, g/mol:	348.241293
ΔH_f, kcal/mol:	-123.34
Dipole, Da:	4.95
IP(EA), eV:	-8.6(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-diethoxyphenyl)ethyl]-2-(1-methylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCSC3CCCCC3

DOS

IR

Vibrations