Geometry & MOs

Info

ID:	304174
PubChem CID:	124498020
Reduced:	SN2O2C19H22 (1)
Stoich.:	AB2C2D19E22 (1)
Weight, g/mol:	250.15037
ΔH_f, kcal/mol:	-44.89
Dipole, Da:	2.75
IP(EA), eV:	-8.57(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2R)-1-ethylpiperidin-2-yl]-2-ethylsulfanylpyridine

Drug info:

PubChemData

Smile

CCSC1=C(C=CC=N1)[C@H]2CCCN2C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations