Geometry & MOs

Info

ID:	436097
PubChem CID:	135193809
Reduced:	F2O2H8C17 (1)
Stoich.:	A2B2C8D17 (1)
Weight, g/mol:	382.042848
ΔH_f, kcal/mol:	-91.67
Dipole, Da:	4.88
IP(EA), eV:	-9.18(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,10-bis(trifluoromethyl)benzo[a]xanthen-12-one

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)F)C3=C(C=C2)OC4=C(C3=O)C=C(C=C4)F

DOS

IR

Vibrations