Geometry & MOs

Info

ID:	428489
PubChem CID:	135167539
Reduced:	F2O2H8C17 (1)
Stoich.:	A2B2C8D17 (1)
Weight, g/mol:	304.073559
ΔH_f, kcal/mol:	-94.69
Dipole, Da:	3.32
IP(EA), eV:	-9.27(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(12-oxobenzo[b]xanthen-10-yl) acetate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C4C=C(C(=CC4=C3)F)F

DOS

IR

Vibrations