Geometry & MOs

Info

ID:	436089
PubChem CID:	135193769
Reduced:	F3O3H11C19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	290.094294
ΔH_f, kcal/mol:	-201.47
Dipole, Da:	4.19
IP(EA), eV:	-9.37(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methoxy-3-methylbenzo[a]xanthen-12-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC4=C3C(=CC=C4)C(F)(F)F

DOS

IR

Vibrations