2-diphenylphosphanylethyl(diphenyl)phosphane; 2-isocyano-2-methyl-propane; technetium; hexafluorophosphate

Systemtic Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 2-isocyano-2-methyl-propane; technetium; hexafluorophosphate Openeye Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 2-isocyano-2-methyl-propane; technetium; hexafluorophosphate CAS Name: 2-diphenylphosphinoethyl(diphenyl)phosphine; 2-isocyano-2-methylpropane; technetium; hexafluorophosphate IUPAC Name: 2-diphenylphosphanylethyl(diphenyl)phosphane; 2-isocyano-2-methylpropane; technetium; hexafluorophosphate Traditional Name: 2-diphenylphosphinoethyl(diphenyl)phosphine; 2-isocyano-2-methyl-propane; technetium; hexafluorophosphate Formula: C62H66F6N2P5Tc- MolecularWeight: 1205.96728

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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)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F.[Tc]

Isomeric SMILES

CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F.[Tc]

InChI

InChI=1S/2C26H24P2.2C5H9N.F6P.Tc/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-5(2,3)6-4;1-7(2,3,4,5)6;/h2*1-20H,21-22H2;2*1-3H3;;/q;;;;-1;