bromanylpalladium(1+); 3H-pyridin-3-ide; triphenylphosphane

Systemtic Name: bromanylpalladium(1+); 3H-pyridin-3-ide; triphenylphosphane Openeye Name: bromopalladium(1+); 3H-pyridin-3-ide; triphenylphosphane CAS Name: bromopalladium(1+); 3H-pyridin-3-ide; triphenylphosphine IUPAC Name: bromopalladium(1+); 3H-pyridin-3-ide; triphenylphosphane Traditional Name: bromopalladium(1+); 3H-pyridin-3-ide; triphenylphosphine Formula: C46H38Br2N2P2Pd2 MolecularWeight: 1053.402842

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Descriptors Computed from Structure

Canonical SMILES:

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=CN=C[C-]=C1.C1=CN=C[C-]=C1.Br[Pd+].Br[Pd+]

Isomeric SMILES

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=CN=C[C-]=C1.C1=CN=C[C-]=C1.Br[Pd+].Br[Pd+]

InChI

InChI=1S/2C18H15P.2C5H4N.2BrH.2Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2-4-6-5-3-1;;;;/h2*1-15H;2*1-2,4-5H;2*1H;;/q;;2*-1;;;2*+2/p-2