carbon monoxide; 2-diphenylphosphanylethyl(trimethyl)azanium; 2-methylpropane-2-thiolate; rhodium; tetraphenylboranuide

Systemtic Name: carbon monoxide; 2-diphenylphosphanylethyl(trimethyl)azanium; 2-methylpropane-2-thiolate; rhodium; tetraphenylboranuide Openeye Name: carbon monoxide; 2-diphenylphosphanylethyl(trimethyl)ammonium; 2-methylpropane-2-thiolate; rhodium; tetraphenylboranuide CAS Name: carbon monoxide; 2-diphenylphosphinoethyl(trimethyl)ammonium; 2-methyl-2-propanethiolate; rhodium; tetraphenylboranuide IUPAC Name: carbon monoxide; 2-diphenylphosphanylethyl(trimethyl)azanium; 2-methylpropane-2-thiolate; rhodium; tetraphenylboranuide Traditional Name: carbon monoxide; 2-diphenylphosphinoethyl(trimethyl)ammonium; 2-methylpropane-2-thiolate; rhodium; tetraphenylboranuide Formula: C92H104B2N2O2P2Rh2S2-2 MolecularWeight: 1623.332882

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC(C)(C)[S-].CC(C)(C)[S-].C[N+](C)(C)CCP(C1=CC=CC=C1)C2=CC=CC=C2.C[N+](C)(C)CCP(C1=CC=CC=C1)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[Rh].[Rh]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC(C)(C)[S-].CC(C)(C)[S-].C[N+](C)(C)CCP(C1=CC=CC=C1)C2=CC=CC=C2.C[N+](C)(C)CCP(C1=CC=CC=C1)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[Rh].[Rh]

InChI

InChI=1S/2C24H20B.2C17H23NP.2C4H10S.2CO.2Rh/c2*1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;2*1-18(2,3)14-15-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17;2*1-4(2,3)5;2*1-2;;/h2*1-20H;2*4-13H,14-15H2,1-3H3;2*5H,1-3H3;;;;/q2*-1;2*+1;;;;;;/p-2