Geometry & MOs

Info

ID:	15191
PubChem CID:	432687
Reduced:	PO3H9F12C18 (1)
Stoich.:	AB3C9D12E18 (1)
Weight, g/mol:	532.009769
ΔH_f, kcal/mol:	-750.54
Dipole, Da:	8.45
IP(EA), eV:	-10.62(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-3,3,3',3'-tetrakis(trifluoromethyl)-1,1'-spirobi[2,1lambda5-benzoxaphosphole]

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(OP23(C4=CC=CC=C4C(O3)(C(F)(F)F)C(F)(F)F)O)(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations