(Z)-2,3-bis(diphenylphosphanyl)but-2-enedioic acid; dibutyltin(2+); gold(1+)

Systemtic Name: (Z)-2,3-bis(diphenylphosphanyl)but-2-enedioic acid; dibutyltin(2+); gold(1+) Openeye Name: (Z)-2,3-bis(diphenylphosphanyl)but-2-enedioic acid; dibutyltin(2+); gold(1+) CAS Name: (Z)-2,3-bis(diphenylphosphino)-2-butenedioic acid; dibutyltin(2+); gold(1+) IUPAC Name: (Z)-2,3-bis(diphenylphosphanyl)but-2-enedioic acid; dibutyltin(2+); gold(1+) Traditional Name: (Z)-2,3-bis(diphenylphosphino)but-2-enedioic acid; dibutyltin(2+); gold(1+) Formula: C72H80AuO8P4Sn2+5 MolecularWeight: 1631.682394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C1=CC=C(C=C1)P(C2=CC=CC=C2)C(=C(C(=O)O)P(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C(=C(C(=O)O)P(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O.[Au+]

Isomeric SMILES

CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C1=CC=C(C=C1)P(/C(=C(\P(C2=CC=CC=C2)C3=CC=CC=C3)/C(=O)O)/C(=O)O)C4=CC=CC=C4.C1=CC=C(C=C1)P(/C(=C(\P(C2=CC=CC=C2)C3=CC=CC=C3)/C(=O)O)/C(=O)O)C4=CC=CC=C4.[Au+]

InChI

InChI=1S/2C28H22O4P2.4C4H9.Au.2Sn/c2*29-27(30)25(33(21-13-5-1-6-14-21)22-15-7-2-8-16-22)26(28(31)32)34(23-17-9-3-10-18-23)24-19-11-4-12-20-24;4*1-3-4-2;;;/h2*1-20H,(H,29,30)(H,31,32);4*1,3-4H2,2H3;;;/q;;;;;;+1;2*+2/b2*26-25-;;;;;;;