Geometry & MOs

Info

ID:	274919
PubChem CID:	103812525
Reduced:	OSN2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	258.176585
ΔH_f, kcal/mol:	-34.93
Dipole, Da:	5.41
IP(EA), eV:	-8.72(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(2-ethyl-2-methylsulfanylbutyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CSC1CCC(C1)NC(=O)C2C3=CC=CC=C3CCN2

DOS

IR

Vibrations