Geometry & MOs

Info

ID:	304171
PubChem CID:	124497915
Reduced:	SN2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	250.15037
ΔH_f, kcal/mol:	10.73
Dipole, Da:	4.18
IP(EA), eV:	-8.29(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfanyl-5-[(2S)-1-propylpyrrolidin-2-yl]pyridine

Drug info:

PubChemData

Smile

CC(C)CN1CCC[C@@H]1C2=CC=CNC2=S

DOS

IR

Vibrations