Geometry & MOs

Info

ID:	428513
PubChem CID:	135167563
Reduced:	O2H5C9 (2)
Stoich.:	A2B5C9 (2)
Weight, g/mol:	290.094294
ΔH_f, kcal/mol:	-65.42
Dipole, Da:	1.97
IP(EA), eV:	-8.5(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-9-methylbenzo[b]xanthen-12-one

Drug info:

PubChemData

Smile

C1OC2=C(O1)C3=CC4=C(C=C3C=C2)OC5=CC=CC=C5C4=O

DOS

IR

Vibrations