Geometry & MOs

Info

ID:	366589
PubChem CID:	127320118
Reduced:	SO2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-58.8
Dipole, Da:	4.83
IP(EA), eV:	-9.07(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-oxo-N-[(1-propylpiperidin-4-yl)methyl]-2-pyridin-3-ylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C#N)C(=O)N1CSCC1C(=O)N2CCCC2

DOS

IR

Vibrations