bis(trifluoromethylsulfonyl)azanide; gold(1+); methylbenzene; triphenylphosphane

Systemtic Name: bis(trifluoromethylsulfonyl)azanide; gold(1+); methylbenzene; triphenylphosphane Openeye Name: bis(trifluoromethylsulfonyl)azanide; gold(1+); toluene; triphenylphosphane CAS Name: bis(trifluoromethylsulfonyl)azanide; gold(1+); toluene; triphenylphosphine IUPAC Name: bis(trifluoromethylsulfonyl)azanide; gold(1+); toluene; triphenylphosphane Traditional Name: ditriflylazanide; gold(1+); toluene; triphenylphosphine Formula: C47H38Au2F12N2O8P2S4 MolecularWeight: 1570.93468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.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(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Au+].[Au+]

Isomeric SMILES

CC1=CC=CC=C1.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(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Au+].[Au+]

InChI

InChI=1S/2C18H15P.C7H8.2C2F6NO4S2.2Au/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-5-3-2-4-6-7;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;;/h2*1-15H;2-6H,1H3;;;;/q;;;2*-1;2*+1