Geometry & MOs

Info

ID:	428505
PubChem CID:	135167555
Reduced:	O3H14C19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	282.049236
ΔH_f, kcal/mol:	-56.82
Dipole, Da:	1.39
IP(EA), eV:	-8.77(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,10-difluorobenzo[b]xanthen-12-one

Drug info:

PubChemData

Smile

CC1=CC2=CC3=C(C=C2C=C1)OC4=C(C3=O)C=CC(=C4)OC

DOS

IR

Vibrations