Chemistry

Absolute Sustainability: Beyond LCA and Green Chemistry Metrics

Sherwood, J. (Creator), Zenodo, 21 Nov 2022

Dataset

Flexibility and rigidity of fluorinated chains as tools in the design of bulk structure of ionic liquid mixtures

BRUCE, D. W. (Creator), Bruno, D. (Creator), Naomi, E. (Creator), Joshua, L. (Creator), Sarah, R. (Creator) & Slattery, J. M. (Creator), Institut Laue-Langevin (ILL), 2023

DOI: 10.5291/ill-data.9-11-2147

Dataset

Dataset for Crossing the Solubility Rubicon: 15-Crown-5 Facilitates the Preparation of Water-Soluble Sulfo-NHS Esters in Organic Solvents

Parkin, A. (Creator), Yates, N. (Creator), Miles, C. (Creator), Spicer, C. (Creator) & Fascione, M. A. (Creator), University of York, 12 Dec 2023

DOI: 10.15124/74602a04-30c4-438f-8a17-f05fd45c160b

Dataset

1,2,4-Triazolium Ions as Flexible Scaffolds for the Construction of Polyphilic Ionic Liquid Crystals

Slattery, J. M. (Creator) & Bruce, D. W. (Contributor), University of York, 14 Aug 2018

DOI: 10.15124/c6afed50-5dd2-4b68-8f86-a37023b55824

Dataset

MALDI-TOF MS spectra of archaeological whale bone specimens from Atlantic Europe

van den Hurk, Y. (Creator), Sikström, F. (Creator), Amkreutz, L. (Creator), Bleasdale, M. (Creator), Borvon, A. (Creator), Ephrem, B. (Creator), Fernández-Rodríguez, C. (Creator), Gibbs, H. (Creator), Johnsson, L. (Creator), Lehouck, A. (Creator), Martínez Cedeira, J. (Creator), Meng, S. (Creator), Monge Soares, R. (Creator), Moreno, M. (Creator), Nabais, M. (Creator), Nores, C. (Creator), Pis Millán, J. A. (Creator), Riddler, I. (Creator), Schmölcke, U. (Creator), Segschneider, M. (Creator), Speller, C. (Creator), Vretemark, M. (Creator), Wickler, S. (Creator), Collins, M. (Creator), Nadeau, M.-J. (Creator) & Barrett, J. (Creator), Zenodo, 8 Sept 2023

DOI: 10.5061/dryad.zgmsbcch7

Dataset

Data associated with 'Second-harmonic generation and the influence of flexoelectricity in the nematic phases of bent-core oxadiazoles'

Addis, J. (Creator), Kaur, S. (Creator), Binks, D. (Creator), Dickinson, M. (Creator), Greco, C. (Creator), Ferrarini, A. (Creator), Görtz, V. (Creator), Goodby, J. W. (Creator) & Gleeson, H. (Creator), University of Leeds, 30 Jun 2016

DOI: 10.5518/55

Dataset

In Crystallo Lattice Adaptivity Triggered by Solid-Gas Reactions of Cationic Group 7 Pincer Complexes

Goodall, J. C. (Creator), Sajjad, M. A. (Creator), Thompson, E. A. (Creator), Page, S. J. (Creator), Kerrigan, A. M. (Creator), Jenkins, H. T. (Creator), Lynam, J. M. (Creator), Macgregor, S. A. (Creator) & Weller, A. S. (Creator), Zenodo, 7 Aug 2023

DOI: 10.5281/zenodo.8212887

Dataset

Air pollution 01.2014 - 05.2020 (including COVID-19 lockdown) data from Graz, Austria

Lovrić, M. (Creator), Pavlović, K. (Creator), Kern, R. (Creator), Grange, S. K. (Creator), Vuković, M. (Creator) & Haberl, M. (Creator), Zenodo, 13 Aug 2020

DOI: 10.5281/zenodo.3982670

Dataset

Electrochemical evidence that pyranopterin redox chemistry controls the catalysis of YedY, a mononuclear Mo enzyme

Parkin, A. (Creator) & Adamson, H. (Creator), University of York, 27 Oct 2015

DOI: 10.15124/379fdb1b-fef9-49db-8365-9751c8aed7bb

Dataset

Research data supporting "Synthesis of phospho-amino acid analogues as tissue adhesive cement additives"

Spicer, C. D. (Creator), Pujari-Palmer, M. (Creator), Autefage, H. (Creator), Insley, G. (Creator), Procter, P. (Creator), Engqvist, H. (Creator) & Stevens, M. M. (Creator), Zenodo, 11 Feb 2020

DOI: 10.5281/zenodo.3648668

Dataset

Updated restraint dictionaries for carbohydrates in the pyranose form

Atanasova, M. (Creator), Nicholls, R. A. (Creator), Joosten, R. (Creator) & Agirre, J. (Creator), Zenodo, 7 Dec 2021

DOI: 10.5281/zenodo.5764924

Dataset

DFT study of the ring opening of cyclohexene oxide by an aminophosphonium salt

Buchard, A. P. (Creator), Clark, E. F. (Creator), Dunstan, E. (Creator) & Kociok-Kohn, G. (Creator), figshare, 27 Nov 2024

DOI: 10.6084/m9.figshare.26487826

Dataset

Models and source data for MuML dipole fitting

Veit, M. (Creator), Wilkins, D. M. (Creator), Yang, Y. (Creator), DiStasio Jr, R. A. (Creator) & Ceriotti, M. (Creator), Zenodo, 11 May 2020

DOI: 10.5281/zenodo.3820297, https://zenodo.org/record/3820297

Dataset

Thermodynamics and dielectric response of BaTiO₃ by data-driven modeling

Gigli, L. (Creator), Veit, M. (Creator), Kotiuga, M. (Creator), Pizzi, G. (Creator), Marzari, N. (Creator) & Ceriotti, M. (Creator), Materials Cloud, 29 Jun 2022

DOI: 10.24435/materialscloud:9g-k6, https://archive.materialscloud.org/record/2022.88

Dataset

Reaction Optimizer Spreadsheet tool

Sherwood, J. (Creator), Zenodo, 31 Oct 2022

DOI: 10.5281/zenodo.7267827

Dataset

Investigating the surface structure of ionic liquid mixtures using neutron reflectometry

Slattery, J. M. (Creator), BRUCE, D. W. (Creator), Cabry, C. P. (Creator), Campbell, R. A. (Creator), Lucia, D. (Creator), Dalgliesh, R. M. (Creator) & Sarah, R. (Creator), Institut Laue-Langevin (ILL), 2015

DOI: 10.5291/ill-data.9-11-1720

Dataset

Data from: Palaeoproteomics resolves sloth phylogeny

Presslee, S. (Creator), Slater, G. J. (Creator), Pujos, F. (Creator), Forasiepi, A. M. (Creator), Fischer, R. (Creator), Molloy, K. (Creator), Mackie, M. (Creator), Olsen, J. V. (Creator), Kramarz, A. (Creator), Taglioretti, M. (Creator), Scaglia, F. (Creator), Lezcano, M. (Creator), Lanata, J. L. (Creator), Southon, J. (Creator), Feranec, R. (Creator), Bloch, J. (Creator), Hajduk, A. (Creator), Martin, F. M. (Creator), Gismondi, R. S. (Creator), Reguero, M. (Creator), de Muizon, C. (Creator), Greenwood, A. (Creator), Chait, B. T. (Creator), Penkman, K. (Creator), Collins, M. (Creator) & MacPhee, R. D. E. (Creator), Dryad, 7 Jun 2019

DOI: 10.5061/dryad.7dd64gs

Dataset

Human DNA Binding Protein PIF + Z48847594 (OCCUPANCY 0.7)

Brandao-Neto, J. R. (Creator), Bax, B. D. (Creator), Anston, A. (Creator) & Sanders, C. (Creator), Zenodo, 3 Jun 2024

DOI: 10.5281/zenodo.13286280

Dataset

Survey of British calcareous grasslands, 1990 and 2007

Rich, T. C. G. (Creator), Cooper, E. A. (Creator), Rodwell, J. S. (Creator), Malloch, A. J. C. (Creator), Van Den Berg, L. J. L. (Creator), Vergeer, P. (Creator), Smart, S. (Contributor), Guest, D. (Creator), Ashmore, M. R. (Creator), Smart, S. (Contributor) & Centre, N. E. E. I. D. (Contributor), NERC Environmental Information Data Centre, 24 Jun 2015

DOI: 10.5285/38a73c7b-3e3c-4517-a33f-bd28b292b9e1

Dataset

Saikiran Ravi: Asymmetric Clip-Cycle Synthesis of 3-Spiropiperidines

Clarke, P. A. (Creator) & Ravi, S. R. (Contributor), University of York, 2022

DOI: 10.15124/9b3ee35d-7f8f-41a8-a6e1-3f7e2dddf4bf

Dataset

Data for 'Optimising Low Temperature Pyrolysis of Mesoporous Alginate-Derived Starbon® for Selective Heavy Metal Adsorption'

Garland, N. (Creator), Gordon, R. (Creator), McElroy, R. (Creator), Parkin, A. (Creator) & MacQuarrie, D. J. (Creator), University of York, 9 May 2024

DOI: 10.15124/a59d3217-4076-4949-94bb-543e17e74922

Dataset

Mapping out the key carbon-carbon bond forming steps in manganese-catalysed C-H functionalisation

Lynam, J. M. (Creator), Fairlamb, I. J. S. (Creator), Hammarback, L. A. (Creator), Towrie, M. (Data Collector), Clark, I. P. (Data Collector) & Sazanovich, I. (Data Collector), University of York, 1 Jul 2018

DOI: 10.15124/46f25600-736a-408a-b498-8b7f6a5f3f2e, https://webfiles.york.ac.uk/INFODATA/46f25600-736a-408a-b498-8b7f6a5f3f2e and one more link, https://creativecommons.org/licenses/by/4.0/ (show fewer)

Dataset