2-diphenylphosphanylethyl-(3-methylbutyl)-diphenyl-phosphanium; methanal; rhodium(2+); triphenylphosphane; dimethanoate

Systemtic Name: 2-diphenylphosphanylethyl-(3-methylbutyl)-diphenyl-phosphanium; methanal; rhodium(2+); triphenylphosphane; dimethanoate Openeye Name: 2-diphenylphosphanylethyl-isopentyl-diphenyl-phosphonium; formaldehyde; rhodium(2+); triphenylphosphane; diformate CAS Name: 2-diphenylphosphinoethyl-(3-methylbutyl)-diphenylphosphonium; formaldehyde; rhodium(2+); triphenylphosphine; diformate IUPAC Name: 2-diphenylphosphanylethyl-(3-methylbutyl)-diphenylphosphanium; formaldehyde; rhodium(2+); triphenylphosphane; diformate Traditional Name: 2-diphenylphosphinoethyl-isoamyl-diphenyl-phosphonium; formaldehyde; rhodium(2+); triphenylphosphine; diformate Formula: C70H69O5P4Rh+ MolecularWeight: 1217.094404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[P+](CCP(C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C=O.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.C(=O)[O-].C(=O)[O-].[Rh+2]

Isomeric SMILES

CC(C)CC[P+](CCP(C1=CC=CC=C1)C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C=O.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.C(=O)[O-].C(=O)[O-].[Rh+2]

InChI

InChI=1S/C31H35P2.2C18H15P.2CH2O2.CH2O.Rh/c1-27(2)23-25-33(30-19-11-5-12-20-30,31-21-13-6-14-22-31)26-24-32(28-15-7-3-8-16-28)29-17-9-4-10-18-29;2*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;1-2;/h3-22,27H,23-26H2,1-2H3;2*1-15H;2*1H,(H,2,3);1H2;/q+1;;;;;;+2/p-2