Geometry & MOs

Info

ID:	35503
PubChem CID:	7979958
Reduced:	FO3N4H17C19 (1)
Stoich.:	AB3C4D17E19 (1)
Weight, g/mol:	380.128469
ΔH_f, kcal/mol:	-79.61
Dipole, Da:	2.74
IP(EA), eV:	-9.36(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-4-oxophthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CC3=CC=CC=C3F

DOS

IR

Vibrations