Geometry & MOs

Info

ID:	12238
PubChem CID:	133408
Reduced:	O5C16H16 (1)
Stoich.:	A5B16C16 (1)
Weight, g/mol:	288.099774
ΔH_f, kcal/mol:	-173.92
Dipole, Da:	2.91
IP(EA), eV:	-9.11(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,5-dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione

Drug info:

PubChemData

Smile

CC1(CCC(O1)C2=CC(=O)C3=C(C=CC(=C3C2=O)O)O)C

DOS

IR

Vibrations