Geometry & MOs

Info

ID:	304172
PubChem CID:	124497970
Reduced:	SN2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	236.13472
ΔH_f, kcal/mol:	7.83
Dipole, Da:	1.01
IP(EA), eV:	-8.46(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2S)-1-ethylpyrrolidin-2-yl]-2-ethylsulfanylpyridine

Drug info:

PubChemData

Smile

CCCN1CCC[C@H]1C2=CN=C(C=C2)SCC

DOS

IR

Vibrations