Geometry & MOs

Info

ID:	292977
PubChem CID:	117367693
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	246.100442
ΔH_f, kcal/mol:	-47.22
Dipole, Da:	3.34
IP(EA), eV:	-8.53(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1-hydroxycyclopropyl)phenyl]piperazine-2,3-dione

Drug info:

PubChemData

Smile

CCC1=CC=C/C(=C/2\C=C(NN2C)C(=O)O)/C1=O

DOS

IR

Vibrations