2-isocyano-2-methyl-propane; rhodium(3+); triphenylphosphanium

Systemtic Name: 2-isocyano-2-methyl-propane; rhodium(3+); triphenylphosphanium Openeye Name: 2-isocyano-2-methyl-propane; rhodium(3+); triphenylphosphonium CAS Name: 2-isocyano-2-methylpropane; rhodium(3+); triphenylphosphonium IUPAC Name: 2-isocyano-2-methylpropane; rhodium(3+); triphenylphosphanium Traditional Name: 2-isocyano-2-methyl-propane; rhodium(3+); triphenylphosphonium Formula: C46H50N2P2Rh+5 MolecularWeight: 795.755622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Rh+3]

Isomeric SMILES

CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Rh+3]

InChI

InChI=1S/2C18H15P.2C5H9N.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-5(2,3)6-4;/h2*1-15H;2*1-3H3;/q;;;;+3/p+2