Geometry & MOs

Info

ID:	293083
PubChem CID:	117373464
Reduced:	N2O3C13H16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	248.116092
ΔH_f, kcal/mol:	-115.63
Dipole, Da:	2.55
IP(EA), eV:	-9.29(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CC1=CC(=CC=C1)N2CC(=O)NCC2=O)O

DOS

IR

Vibrations