Geometry & MOs

Info

ID:	351549
PubChem CID:	127280437
Reduced:	O2N7C19H25 (1)
Stoich.:	A2B7C19D25 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	14.53
Dipole, Da:	5.6
IP(EA), eV:	-9.42(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-oxo-2-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]ethyl]phthalazin-1-one

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C=NN=N4

DOS

IR

Vibrations