Geometry & MOs

Info

ID:	436085
PubChem CID:	135193752
Reduced:	O2H5C9 (2)
Stoich.:	A2B5C9 (2)
Weight, g/mol:	282.049236
ΔH_f, kcal/mol:	-60.86
Dipole, Da:	2.57
IP(EA), eV:	-8.4(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,9-difluorobenzo[a]xanthen-12-one

Drug info:

PubChemData

Smile

C1OC2=C(O1)C3=C(C=CC4=C3C(=O)C5=CC=CC=C5O4)C=C2

DOS

IR

Vibrations