platinum(2+); 4-[2-[4-(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine; trioctylphosphane

Systemtic Name: platinum(2+); 4-[2-[4-(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine; trioctylphosphane Openeye Name: platinum(2+); 4-[2-[4-[2-(4-pyridyl)ethynyl]phenyl]ethynyl]pyridine; trioctylphosphane CAS Name: platinum(2+); 4-[2-[4-(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine; trioctylphosphine IUPAC Name: platinum(2+); 4-[2-[4-(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine; trioctylphosphane Traditional Name: platinum(2+); 4-[2-[4-[2-(4-pyridyl)ethynyl]phenyl]ethynyl]pyridine; trioctylphosphine Formula: C204H342N6P6Pt3+6 MolecularWeight: 3650.015046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.[Pt+2].[Pt+2].[Pt+2]

Isomeric SMILES

CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCCCCCCP(CCCCCCCC)CCCCCCCC.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.C1=CC(=CC=C1C#CC2=CC=NC=C2)C#CC3=CC=NC=C3.[Pt+2].[Pt+2].[Pt+2]

InChI

InChI=1S/6C24H51P.3C20H12N2.3Pt/c6*1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;3*1-2-18(6-8-20-11-15-22-16-12-20)4-3-17(1)5-7-19-9-13-21-14-10-19;;;/h6*4-24H2,1-3H3;3*1-4,9-16H;;;/q;;;;;;;;;3*+2