Geometry & MOs

Info

ID:	305485
PubChem CID:	124956243
Reduced:	ON2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	309.151098
ΔH_f, kcal/mol:	-57.03
Dipole, Da:	3.89
IP(EA), eV:	-9.1(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3S)-1-pyrrolidin-1-ylsulfonylpiperidin-3-yl]methyl]pyridine

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)[C@@H]2CN(CCO2)C3CCN(CC3)C(=O)C

DOS

IR

Vibrations