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Part 1: Document Description
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Citation |
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Title: |
Data of B3 group for: "Determination of Accessibility and Spatial Distribution of Chiral Rh Diene Complexes Immobilized on SBA-15 via Phosphine‑based NMR Probe Molecules" |
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Identification Number: |
doi:10.18419/darus-3272 |
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Distributor: |
DaRUS |
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Date of Distribution: |
2022-12-13 |
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Version: |
1 |
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Bibliographic Citation: |
Kirchhof, Manuel, 2022, "Data of B3 group for: "Determination of Accessibility and Spatial Distribution of Chiral Rh Diene Complexes Immobilized on SBA-15 via Phosphine‑based NMR Probe Molecules"", https://doi.org/10.18419/darus-3272, DaRUS, V1 |
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Citation |
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Title: |
Data of B3 group for: "Determination of Accessibility and Spatial Distribution of Chiral Rh Diene Complexes Immobilized on SBA-15 via Phosphine‑based NMR Probe Molecules" |
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Identification Number: |
doi:10.18419/darus-3272 |
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Authoring Entity: |
Kirchhof, Manuel (University of Stuttgart, Institute of Organic Chemistry) |
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Grant Number: |
358283783 - SFB 1333 |
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Distributor: |
DaRUS |
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Access Authority: |
Laschat, Sabine |
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Depositor: |
Kirchhof, Manuel |
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Date of Deposit: |
2022-11-22 |
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Holdings Information: |
https://doi.org/10.18419/darus-3272 |
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Study Scope |
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Keywords: |
Chemistry, Asymmetric Catalysis, Rhodium Catalysis, Diene Ligands, Confinement, Phosphine, Probe Molecules, NMR Spectroscopy |
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Topic Classification: |
Heterogenous Catalysis |
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Abstract: |
In this dataset HPLC (high performance liquid chromatography) chromatograms of the products of the rhodium-catalyzed 1,2-addition and NMR spectra of all prepared catalysts and catalysis products (NMR) are included. The described 1,2-addition product is an N-tosyl amide which was formed from the reaction of triphenylboroxine with an N-tosyl imine. The catalysts are the chiral Rh norbornadiene phosphine complexes [RhCl(L1)(P(Ad)2(n-Bu))] and [RhCl(L1)(PPh3)]. Furthermore, the NMR data of phosphine complexation experiments is deposited. This data was collected to screen for suitable phosphines for the later quantification of accessible Rh diene complexes on SBA-15 via solid state NMR. Crystallographic data was published in Cambridge Structural Database (CSD) of the Cambridge Crystallographic Data Centre (CCDC) as stated under related datasets. In this dataset additional data from the crystal structure of [RhCl(L1)(P(Ad)2(n-Bu))] is included (plotted structure, CIF file, PDB file, RES file and a DAT file with tables listing all the significant measuring parameters, bond angles, bond distances and atom coordinates). |
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Kind of Data: |
experimental data |
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Methodology and Processing |
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Sources Statement |
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Data Access |
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Other Study Description Materials |
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Related Studies |
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Structure [RhCl(L1)(P(Ad)2(n-Bu))]: Carolin Rieg, Manuel Kirchhof, Katrin Gugeler, Ann-Katrin Beurer, Lukas Stein, Klaus Dirnberger, Wolfgang Frey, Johanna R. Bruckner, Yvonne Traa, Johannes Kästner, Sabine Ludwigs, Sabine Laschat, Michael Dyballa, CCDC 2195463: Experimental Crystal Structure Determination, 2022, DOI: <a href="https://doi.org/10.5517/ccdc.csd.cc2cpkd1">10.5517/ccdc.csd.cc2cpkd1</a> |
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Related Publications |
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Citation |
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Title: |
Carolin Rieg, Manuel Kirchhof, Katrin Gugeler, Ann-Katrin Beurer, Lukas Stein, Klaus Dirnberger, Wolfgang Frey, Johanna R. Bruckner, Yvonne Traa, Johannes Kästner, Sabine Ludwigs, Sabine Laschat, Michael Dyballa. Determination of accessibility and spatial distribution of chiral Rh diene complexes immobilized on SBA-15 via phosphine-based solid-state NMR probe molecules. Catal. Sci. Technol. 2022, Advance Article. |
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Identification Number: |
10.1039/d2cy01578a |
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Bibliographic Citation: |
Carolin Rieg, Manuel Kirchhof, Katrin Gugeler, Ann-Katrin Beurer, Lukas Stein, Klaus Dirnberger, Wolfgang Frey, Johanna R. Bruckner, Yvonne Traa, Johannes Kästner, Sabine Ludwigs, Sabine Laschat, Michael Dyballa. Determination of accessibility and spatial distribution of chiral Rh diene complexes immobilized on SBA-15 via phosphine-based solid-state NMR probe molecules. Catal. Sci. Technol. 2022, Advance Article. |
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Label: |
checkcif_report_s2867lm.pdf |
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Notes: |
application/pdf |
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plot_s2867_sq.docx |
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Notes: |
application/vnd.openxmlformats-officedocument.wordprocessingml.document |
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Label: |
s2867lm_sq.cif |
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Notes: |
chemical/x-cif |
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s2867lm_sq.pdb |
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Text: | |
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Notes: |
chemical/x-pdb |
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Label: |
s2867lm_sq.res |
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Text: | |
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Notes: |
text/plain |
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Label: |
s2867tab.dat |
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Notes: |
text/x-fixed-field |
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Label: |
1,2-Addition with [RhCl(L1)PPh3].xps |
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Notes: |
application/vnd.ms-xpsdocument |
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Label: |
Additional NMR experiments.zip |
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Notes: |
application/zip |
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Label: |
Phosphane screening.zip |
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Notes: |
application/zip |
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Label: |
[RhCl(L1)PAd2(n-Bu)].zip |
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Notes: |
application/zip |
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Label: |
[RhCl(L1)PPh3].zip |
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Notes: |
application/zip |