Geometry & MOs

Info

ID:	25269
PubChem CID:	622072
Reduced:	OCl2N2H6C12 (1)
Stoich.:	AB2C2D6E12 (1)
Weight, g/mol:	292.073559
ΔH_f, kcal/mol:	59.24
Dipole, Da:	1.2
IP(EA), eV:	-8.99(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(hydroxymethyl)-6-methylnaphtho[1,2-g][1]benzofuran-10,11-dione

Drug info:

PubChemData

Smile

C1=CC2=[N+](C3=C(C=CC(=C3)Cl)N=C2C(=C1)Cl)[O-]

DOS

IR

Vibrations