Geometry & MOs

Info

ID:	35508
PubChem CID:	7979963
Reduced:	O4N5H21C22 (1)
Stoich.:	A4B5C21D22 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-72.17
Dipole, Da:	5.91
IP(EA), eV:	-9.04(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-oxo-N'-[(2S)-2-phenylpentanoyl]phthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)N4CCCC4=O

DOS

IR

Vibrations