Geometry & MOs

Info

ID:	356817
PubChem CID:	127292357
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	291.121906
ΔH_f, kcal/mol:	-70.1
Dipole, Da:	3.77
IP(EA), eV:	-8.9(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-4-ylmethyl)-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CN(C1)C(=O)NCC3=C4C(=CC=C3)OCO4

DOS

IR

Vibrations