Geometry & MOs

Info

ID:	304191
PubChem CID:	124498457
Reduced:	SN2C16H18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	270.11907
ΔH_f, kcal/mol:	56.12
Dipole, Da:	3.54
IP(EA), eV:	-8.53(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2S)-1-methylpyrrolidin-2-yl]-2-phenylsulfanylpyridine

Drug info:

PubChemData

Smile

CN1CCC[C@@H]1C2=C(N=CC=C2)SC3=CC=CC=C3

DOS

IR

Vibrations