Geometry & MOs

Info

ID:	358114
PubChem CID:	127295659
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	352.156912
ΔH_f, kcal/mol:	-106.69
Dipole, Da:	4.55
IP(EA), eV:	-8.69(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methylsulfonylpyridin-3-yl)-3-piperidin-1-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NCC3COC4=CC=CC=C4O3

DOS

IR

Vibrations