Geometry & MOs

Info

ID:	72773
PubChem CID:	48416529
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	371.159354
ΔH_f, kcal/mol:	-78.1
Dipole, Da:	3.18
IP(EA), eV:	-9.13(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-oxo-2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]ethyl]-2H-phthalazine-1,4-dione

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCNC4=O

DOS

IR

Vibrations