Geometry & MOs

Info

ID:	349882
PubChem CID:	127276687
Reduced:	ON2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	334.12772
ΔH_f, kcal/mol:	-69.81
Dipole, Da:	4.39
IP(EA), eV:	-8.93(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(2-methyl-3-oxopiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1CC2CCCCC2

DOS

IR

Vibrations