Geometry & MOs

Info

ID:	175108
PubChem CID:	75856386
Reduced:	SN4O5H16C22 (1)
Stoich.:	AB4C5D16E22 (1)
Weight, g/mol:	362.090272
ΔH_f, kcal/mol:	-22.49
Dipole, Da:	8.14
IP(EA), eV:	-9.33(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-methyl-1-benzofuran-2-yl)-2-oxoethyl] 4-oxo-1H-phthalazine-1-carboxylate

Drug info:

PubChemData

Smile

C1C(N(N=C1C2=CC=CS2)C(=O)COC(=O)C3C4=CC=CC=C4C(=O)N=N3)C5=CC=CO5

DOS

IR

Vibrations