Geometry & MOs

Info

ID:	35507
PubChem CID:	7979962
Reduced:	O3N4C20H20 (1)
Stoich.:	A3B4C20D20 (1)
Weight, g/mol:	419.159354
ΔH_f, kcal/mol:	-43.29
Dipole, Da:	3.77
IP(EA), eV:	-9.32(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-oxo-N'-[4-(2-oxopyrrolidin-1-yl)benzoyl]phthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=C(C=C3)C)C

DOS

IR

Vibrations