Geometry & MOs

Info

ID:	304158
PubChem CID:	124497723
Reduced:	ON3C23H25 (1)
Stoich.:	AB3C23D25 (1)
Weight, g/mol:	208.10342
ΔH_f, kcal/mol:	25.07
Dipole, Da:	1.62
IP(EA), eV:	-8.4(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylsulfanyl-5-[(2R)-piperidin-2-yl]pyridine

Drug info:

PubChemData

Smile

CC1=CC=C(N1C2=C(C=CC=N2)[C@H]3CCCCN3C(=O)C4=CC=CC=C4)C

DOS

IR

Vibrations