Geometry & MOs

Info

ID:	396727
PubChem CID:	135029097
Reduced:	OH6C8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	312.099774
ΔH_f, kcal/mol:	-8.88
Dipole, Da:	2.89
IP(EA), eV:	-9.92(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,11-dihydroxy-3,3-dimethyl-1,2-dihydropyrano[3,2-a]xanthen-12-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/2\[C@H](C3=CC=CC=C3C2=O)O

DOS

IR

Vibrations