Geometry & MOs

Info

ID:	3646
PubChem CID:	9909
Reduced:	O5H10C14 (1)
Stoich.:	A5B10C14 (1)
Weight, g/mol:	258.052823
ΔH_f, kcal/mol:	-159.17
Dipole, Da:	6.35
IP(EA), eV:	-9.13(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,9-dihydroxy-3-methoxyxanthen-1-one

Drug info:

PubChemData

Smile

COC1=CC(=O)C2=C(C3=C(C=CC(=C3)O)OC2=C1)O

DOS

IR

Vibrations