Data supporting study of Pd(II) metallo-cage species from cyclotriguaiacylene derived ligands

Cookson, Nikki J.

Fisher, Julie

Fowler, Jonathan M.

Hardie, Michaele J.

Henkelis, James J.

Martin, David P.

Ronson, Tanya K.

Thorp-Greenwood, Flora L.

Willans, Charlotte E.

English

Research Data Leeds Repository (University of Leeds)

1. Compound codes and abbreviations:L1 = ()-2,7,12-trimethoxy-3,8,13-tris(4-pyridylcarboxy)-10,15-dihydro-5H-tribenzo[a,d,g]cyclononeneFL1 = ()-2,7,12-trimethoxy-3,8,13-tris(3-fluoro-4-pyridylcarboxy)-10,15-dihydro-5H-tribenzo[a,d,g]cyclononeneL2 = ()-2,7,12-trimethoxy-3,8,13-tris(methylbenzimidazol-1-yl)-10,15-dihydro-5H-tribenzo[a,d,g]cyclononeneCTG = cyclotriguaiacylenedppp = bis(diphenylphosphino)propaneen = ethylenediamineOTf = triflateNO3 = nitratePd = palladiumCl = chlorideMeCN/CD3CN = D3-acetonitrileMeNO2/CD3NO2 = D3-nitromethaneDMSO = D6-dimethylsulfoxideCDCl3 = D1-chloroform2. Data DepositedNMR.zipNMR data as fid or mnova files for L1, FL1, L2, complexes [Pd3(dppp)3(L1)2]∙6OTf, [Pd3(dppp)3(FL1)2]∙6OTf, starting material [Pd(dppp)(OTf)2], mixtures of Pd(en)(NO3)2 with L1/FL1,mixtures of PdCl2 with L2.Xray.zipL2, L2∙CTG, [Pd3(dppp)3(FL1)2]∙6(OTf) and [Pd3Cl6(L2)2]Final refinement files .res (shelx results file); .hkl data files (pre and post-SQUEEZE); crystallographicinformation file (.cif) and structure factors (.fcf); raw data and integration detailsPowder diffraction pattern for L2∙CTG Analysis.zipMass spectra, infrared spectra, CHN analysis

Metallo-cryptophane cages from cis-linked and trans-linked strategies.

http://archive.researchdata.leeds.ac.uk/177/1/readme.pdf

Metallo-cryptophane cages from cis-linked and trans-linked strategies.

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