All primary data files of published research from CRC 1333, e.g. from journal articles.
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161 to 170 of 185 Results
SFB 1333 - Estes group, ITC(Universität Stuttgart)
Apr 8, 2021
In this dataverse you can find all research data related to publications of the Estes group generated within the CRC 1333.
SFB 1333 B3 - Laschat group, IOC(Universität Stuttgart)
Apr 8, 2021
In this dataverse you can find all research data related to publications of the group generated within the context of CRC 1333.
SFB 1333 A4 - Bruckner group(Universität Stuttgart)
Apr 8, 2021
In this dataverse you can find all research data related to publications of the group generated within the context of CRC 1333.
Data for: Stereoselective Olefin Ring-Opening Cross Metathesis Catalyzed by Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes
Data for: Stereoselective Olefin Ring-Opening Cross Metathesis Catalyzed by Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes
Apr 6, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Momin, Mohasin, 2021, "Data for: Stereoselective Olefin Ring-Opening Cross Metathesis Catalyzed by Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes", https://doi.org/10.18419/DARUS-1694, DaRUS, V1
The influence of the structure of cationic molybdenum imido alkylidene N-heterocyclic carbene (NHC) catalysts, i. e. of [Mo(N-2-tert-butyl-C6H4) (CHCMe2Ph)(NHC)X+ B(ArF)4 ] (NHC=1,3-di(2-Pr) imidazol-2-ylidene (iPr), 1,3-dimesitylimidazol-2-ylidene (IMes); X=pyrrolide, OCH(CF3)2, B(ArF)4 = tetrakis(3,5-bis(trifluoromethyl)phenyl)borate) and of [Mo(...
Data for: Tuning the Latent Behavior of Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes in Dicyclopentadiene Polymerization
Apr 6, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Momin, Mohasin; Musso, Janis; Frey, Wolfgang; Buchmeiser, Michael, 2021, "Data for: Tuning the Latent Behavior of Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes in Dicyclopentadiene Polymerization", https://doi.org/10.18419/DARUS-1696, DaRUS, V1
We report the synthesis of O- and N-chelated hexacoordinated molybdenum imido alkylidene N-heterocyclic carbene (NHC) bistriflate and pentacoordinated molybdenum imido alkylidene NHC monotriflate monoalkoxide complexes and their use as thermally latent and in some cases air-stable precatalysts in the ring-opening metathesis polymerization (ROMP) of...
Data For Publication "Tetrazine metallation boosts rate and regioselectivity of inverse electron demand Diels-Alder (iEDDA) addition of dienophiles"
Data For Publication "Tetrazine metallation boosts rate and regioselectivity of inverse electron demand Diels-Alder (iEDDA) addition of dienophiles"
Apr 5, 2021 - SFB 1333 C2 - Ringenberg group, IAC
Schnierle, Marc; Blickle, Svenja; Filippou, Vasileios; Ringenberg, Mark, 2021, "Data For Publication "Tetrazine metallation boosts rate and regioselectivity of inverse electron demand Diels-Alder (iEDDA) addition of dienophiles"", https://doi.org/10.18419/DARUS-1172, DaRUS, V1
The data contained within comes from the report concerning the coordination of rhenium complexes to tetrazine ligand in [ReCl(CO)3(TzPy)] [1] (TzPy = 3-(2-pyridyl)-1,2,4,5-tetrazine) and the rates of addition of different dienophiles to the tetrazine. Tetrazine coordination lowers the DS‡ contribution to DeltaG‡ for iEDDA addition.
Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory'
Mar 29, 2021 - Institute of Thermodynamics and Thermal Process Engineering
Sauer, Elmar; Gross, Joachim, 2021, "Supplementary material for 'Prediction of Adsorption Isotherms and Selectivities: Comparison between Classical Density Functional Theory Based on the Perturbed-Chain Statistical Associating Fluid Theory Equation of State and Ideal Adsorbed Solution Theory'", https://doi.org/10.18419/DARUS-1643, DaRUS, V1
This dataset contains simulation results in ASCII format accompanying the mentioned publication. The filename is structured in the following kind: Number of the figure in which the data is shown, method of simulation (TMMC Transition Matrix Monte Carlo, DFT Density Functional Theory), adsorbate(s), temperature, poregeometry (cylindrical pore or sli...
Data for "Cationic Tungsten Alkylidyne N‐Heterocyclic Carbene Complexes: Synthesis and Reactivity in Alkyne Metathesis"
Mar 26, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Hauser, Philipp Manuel; van der Ende, Melita; Groos, Jonas; Frey, Wolfgang; Wang, Dongren; Buchmeiser, Michael, 2021, "Data for "Cationic Tungsten Alkylidyne N‐Heterocyclic Carbene Complexes: Synthesis and Reactivity in Alkyne Metathesis"", https://doi.org/10.18419/DARUS-1679, DaRUS, V1
All primary data files and processed data of the journal article from Buchmeiser group. Productivities in alkyne metathesis reactions (Paper, Table 1) was examined via gas-chromatography / mass spectrometry analysis and can be found in the GC-MS data folder. Novel complexes were examined via NMR spectroscopy and the spectra can be found in NMR data...
Replication data of Buchmeiser group for: Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Catalyst
Mar 25, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Kesharwani, Manoj Kumar; Elser, Iris; Musso, Janis; Buchmeiser, Michael; Kästner, Johannes, 2021, "Replication data of Buchmeiser group for: Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N‑Heterocyclic Carbene Catalyst", https://doi.org/10.18419/DARUS-1714, DaRUS, V1
DFT calculations were carried out to explore all relevant pathways for the ring-closing metathesis (RCM) reaction of a cationic molybdenum imido alkylidene N-heterocyclic carbene (NHC) catalyst with α,ω-dienes.The 1H NMR spectrum of the reaction between [Mo(N-2,6-Me2-C6H3)(CHCMe2Ph)(IMes)(OCH(CF3)2)+ B(ArF)4–] and 1,7-octadiene confirms the absence...
Publication data for: "Cationic Tungsten Oxo Alkylidene N-Heterocyclic Carbene Complexes via Hydrolysis of Cationic Alkylidyne Progenitors"
Mar 23, 2021 - SFB 1333 A1+B2 - Buchmeiser group, IPOC-MSF
Hauser, Philipp Manuel; Musso, Janis; Frey, Wolfgang; Buchmeiser, Michael, 2021, "Publication data for: "Cationic Tungsten Oxo Alkylidene N-Heterocyclic Carbene Complexes via Hydrolysis of Cationic Alkylidyne Progenitors"", https://doi.org/10.18419/DARUS-1772, DaRUS, V1
All primary data files and processed data of the journal article from Buchmeiser group, in which cationic tungsten oxo NHC complexes are synthesized via hydrolysis of cationic alkylidyne NHC complexes. NMR data of all pure compounds and NMR experiments. Gc-MS data of Metathesis reactions and crystal data for all crystal structures.
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