Geometry & MOs

Info

ID:	259787
PubChem CID:	103174511
Reduced:	NO3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-88.94
Dipole, Da:	6.74
IP(EA), eV:	-9.32(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,4-dimethoxypyridin-2-yl)methyl]-6-ethylpiperazine-2,5-dione

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OC2=C(C=C(C=C2)C)C(=O)O

DOS

IR

Vibrations