Geometry & MOs

Info

ID:

19433

PubChem CID:

563638

Reduced:

N2O2H12C15 (1)

Stoich.:

A2B2C12D15 (1)

Weight, g/mol:

252.089878

ΔHf, kcal/mol:

1.0

Dipole, Da:

4.37

IP(EA), eV:

-8.97(-0.92)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-phenylmethoxy-2H-phthalazin-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=NNC(=O)C3=CC=CC=C32

DOS

IR

Vibrations