Geometry & MOs

Info

ID:

341663

PubChem CID:

127264356

Reduced:

AuOPH23C25 (1)

Stoich.:

ABCD23E25 (1)

Weight, g/mol:

547.06845

ΔHf, kcal/mol:

166.53

Dipole, Da:

1.52

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.893268

Charge, e:

 0

Chem-info

IUPAC name:

gold;triphenylphosphanium;tetrafluoroborate

Drug info:

PubChemData

Smile

COC1=CC=C[C-]=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Au+]

DOS

IR

Vibrations