Geometry & MOs

Info

ID:	23663
PubChem CID:	605349
Reduced:	O2H3C5 (2)
Stoich.:	A2B3C5 (2)
Weight, g/mol:	190.026609
ΔH_f, kcal/mol:	-86.74
Dipole, Da:	1.73
IP(EA), eV:	-9.87(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)O)C(=O)C3C(C2=O)O3

DOS

IR

Vibrations