1-(1-diphenylphosphanylethoxy)ethyl-diphenyl-phosphane; technetium(6+); icosaperchlorate

Systemtic Name: 1-(1-diphenylphosphanylethoxy)ethyl-diphenyl-phosphane; technetium(6+); icosaperchlorate Openeye Name: 1-(1-diphenylphosphanylethoxy)ethyl-diphenyl-phosphane; technetium(6+); icosaperchlorate CAS Name: 1-(1-diphenylphosphinoethoxy)ethyl-diphenylphosphine; technetium(6+); eicosaperchlorate IUPAC Name: 1-(1-diphenylphosphanylethoxy)ethyl-diphenylphosphane; technetium(6+); icosaperchlorate Traditional Name: 1-(1-diphenylphosphinoethoxy)ethyl-diphenyl-phosphine; technetium(6+); eicosaperchlorate Formula: C56H52Cl20O82P4Tc4 MolecularWeight: 3261.546788

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C(OC([CH2-])P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.[CH2-]C(OC([CH2-])P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Tc+6].[Tc+6].[Tc+6].[Tc+6]

Isomeric SMILES

[CH2-]C(OC([CH2-])P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.[CH2-]C(OC([CH2-])P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Tc+6].[Tc+6].[Tc+6].[Tc+6]

InChI

InChI=1S/2C28H26OP2.20ClHO4.4Tc/c2*1-23(30(25-15-7-3-8-16-25)26-17-9-4-10-18-26)29-24(2)31(27-19-11-5-12-20-27)28-21-13-6-14-22-28;20*2-1(3,4)5;;;;/h2*3-24H,1-2H2;20*(H,2,3,4,5);;;;/q2*-2;;;;;;;;;;;;;;;;;;;;;4*+6/p-20