Geometry & MOs

Info

ID:	358351
PubChem CID:	127295896
Reduced:	FON4C19H23 (1)
Stoich.:	ABC4D19E23 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-33.04
Dipole, Da:	3.89
IP(EA), eV:	-8.95(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations