(1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphane; hexafluorophosphate

Systemtic Name: (1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphane; hexafluorophosphate Openeye Name: (1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphane; hexafluorophosphate CAS Name: (1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphine; hexafluorophosphate IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphane; hexafluorophosphate Traditional Name: (1Z,5Z)-cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphine; hexafluorophosphate Formula: C31H50F6IrNP2- MolecularWeight: 804.890341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CC=CCCC=C1.C1=CC=NC=C1.F[P-](F)(F)(F)(F)F.[Ir]

Isomeric SMILES

C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1/C=C\CC/C=C\C1.C1=CC=NC=C1.F[P-](F)(F)(F)(F)F.[Ir]

InChI

InChI=1S/C18H33P.C8H12.C5H5N.F6P.Ir/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-8-7-5-3-1;1-2-4-6-5-3-1;1-7(2,3,4,5)6;/h16-18H,1-15H2;1-2,7-8H,3-6H2;1-5H;;/q;;;-1;/b;2-1-,8-7-;;;