Geometry & MOs

Info

ID:	35487
PubChem CID:	7979937
Reduced:	N2Cl3O4H11C15 (1)
Stoich.:	A2B3C4D11E15 (1)
Weight, g/mol:	362.13789
ΔH_f, kcal/mol:	-65.37
Dipole, Da:	2.7
IP(EA), eV:	-9.52(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-oxo-N'-[(E)-3-phenylprop-2-enoyl]phthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=C(C=CC(=C1)Cl)Cl)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations