Geometry & MOs

Info

ID:	428496
PubChem CID:	135167546
Reduced:	O2F3H9C18 (1)
Stoich.:	A2B3C9D18 (1)
Weight, g/mol:	282.049236
ΔH_f, kcal/mol:	-162.35
Dipole, Da:	5.27
IP(EA), eV:	-9.28(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-difluorobenzo[b]xanthen-12-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C4C=CC=C(C4=C3)C(F)(F)F

DOS

IR

Vibrations