palladium(2+); triphenylphosphane; dihydroxide; ditetrafluoroborate

Systemtic Name: palladium(2+); triphenylphosphane; dihydroxide; ditetrafluoroborate Openeye Name: palladium(2+); triphenylphosphane; dihydroxide; ditetrafluoroborate CAS Name: palladium(2+); triphenylphosphine; dihydroxide; ditetrafluoroborate IUPAC Name: palladium(2+); triphenylphosphane; dihydroxide; ditetrafluoroborate Traditional Name: palladium(2+); triphenylphosphine; dihydroxide; ditetrafluoroborate Formula: C72H62B2F8O2P4Pd2 MolecularWeight: 1469.60575

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[OH-].[OH-].[Pd+2].[Pd+2]

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[OH-].[OH-].[Pd+2].[Pd+2]

InChI

InChI=1S/4C18H15P.2BF4.2H2O.2Pd/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*2-1(3,4)5;;;;/h4*1-15H;;;2*1H2;;/q;;;;2*-1;;;2*+2/p-2