Geometry & MOs

Info

ID:	35501
PubChem CID:	7979955
Reduced:	SN4O4C20H20 (1)
Stoich.:	AB4C4D20E20 (1)
Weight, g/mol:	392.148455
ΔH_f, kcal/mol:	-66.83
Dipole, Da:	5.79
IP(EA), eV:	-8.81(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations