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2020

Alkene syn- and anti-oxyamination with malonoyl peroxides

Curle, J. M., Perieteanu, M. C., Humphreys, P. G., Kennedy, A. R. & Tomkinson, N. C. O., 30 Jan 2020, In : Organic Letters. 6 p.

Research output: Contribution to journalArticle

Open Access
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Peroxides
Alkenes
peroxides
alkenes
Trifluoroacetic Acid
Open Access
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Biological Products
Isotopes
Catalysis
Hydrogen
Ion exchange
2019

Alkali metal and stoichiometric effects in intermolecular hydroamination catalysed by lithium, sodium and potassium magnesiates

Davin, L., Hernán-Gómez, A., McLaughlin, C., Kennedy, A. R., McLellan, R. & Hevia, E., 16 Apr 2019, In : Dalton Transactions. 48, 23, p. 8122-8130 9 p.

Research output: Contribution to journalArticle

Alkali Metals
Lithium
Potassium
Sodium
Deprotonation
1 Citation (Scopus)
20 Downloads (Pure)

Alkali metal effects in trans-metal-trapping (TMT): comparing LiTMP with NaTMP in cooperative MTMP/Ga(CH2SiMe3)3 metalation reactions

McLellan, R., Uzelac, M., Bole, L. J., Gil-Negrete, J. M., Armstrong, D. R., Kennedy, A. R., Mulvey, R. E. & Hevia, E., 15 Jan 2019, In : Synthesis. 51, 05, p. 1207-1215 9 p.

Research output: Contribution to journalArticle

Open Access
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Alkali Metals
Alkali metals
Metals
Diamines
anisole
1 Citation (Scopus)

A reappraisal of the Ni-[(Benzylprolyl)amino]benzophenone complex in the synthesis of α,α-disubstituted amino acid derivatives

Watson, M. E., Jamieson, C., Kennedy, A. R. & Mason, A. M., 6 Sep 2019, In : Tetrahedron. 75, 36, 130485.

Research output: Contribution to journalArticle

Proline
Derivatives
Amino Acids
Peptides
Erosion

Backbone reactivity of lithium β-Diketiminate (NacNac) complexes with CO 2, tBuNCO and iPrNCO

Gauld, R. M., McLellan, R., Kennedy, A. R., Barker, J., Reid, J. & Mulvey, R. E., 18 Nov 2019, In : Chemistry - A European Journal. 25, 64, p. 14728-14734 7 p.

Research output: Contribution to journalArticle

Carbon Monoxide
Lithium
Dimers
Amides
Lithium Compounds
9 Downloads (Pure)

Catalyst- and solvent-free synthesis of 2-fluoro-N- (3-methylsulfanyl-1H-1,2,4-triazol-5-yl)benzamide through a microwave-assisted Fries rearrangement: X-ray structural and theoretical studies

Moreno-Fuquen, R., Arango-Daraviña, K., Becerra, D., Castillo, J-C., Kennedy, A. R. & Macías, M. A., 1 Mar 2019, In : Acta Crystallographica Section C: Structural Chemistry. C75, Part 3, p. 359-371 13 p.

Research output: Contribution to journalArticle

Open Access
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acylation
Acylation
Amides
amides
Density functional theory

Chasing the 'killer' phonon mode for the rational design of low disorder, high mobility molecular semiconductors

Schweicher, G., D'Avino, G., Ruggiero, M. T., Harkin, D. J., Broch, K., Venkateshvaran, D., Liu, G., Richard, A., Ruzie, C., Armstrong, J., Kennedy, A. R., Shankland, K., Takimiya, K., Geerts, Y. H., Zeitler, J. A., Fratini, S. & Sirringhaus, H., 25 Jul 2019, (Accepted/In press) In : Advanced Materials. 33 p.

Research output: Contribution to journalArticle

Molecular vibrations
Semiconductor materials
Inelastic neutron scattering
Semiconducting organic compounds
Electrons
10 Downloads (Pure)
Open Access
File
Azo Compounds
Azo dyes
dyes
Metals
Ions
1 Citation (Scopus)
8 Downloads (Pure)
Open Access
File
Nitrogen fixation
Alkali Metals
Anhydrides
Alkali metals
Lithium
12 Downloads (Pure)

Insight from electron density and energy framework analysis on the structural features of Fx-TCNQ (x = 0, 2, 4) family of molecules

Shukla, R., Ruzié, C., Schweicher, G., Kennedy, A. R., Geerts, Y. H., Chopra, D. & Chattopadhyay, B., 28 Feb 2019, In : Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials. 75, Part 1, p. 71-78 8 p.

Research output: Contribution to journalArticle

Open Access
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Carrier concentration
electron energy
Molecules
Crystal structure
molecules
11 Downloads (Pure)
Open Access
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Alkynes
Lithium
Nuclear magnetic resonance
Deprotonation
X ray crystallography

Magnesium-mediated arylation of amines via C-F bond activation of fluoroarenes

Bole, L. J., Davin, L., Kennedy, A. R., McLellan, R. & Hevia, E., 13 Mar 2019, In : Chemical Communications. 55, 30, p. 4339-4342 4 p.

Research output: Contribution to journalArticle

Amides
Magnesium
amides
Amines
magnesium
8 Downloads (Pure)
Open Access
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Crystal structure
Coordination Complexes
X rays
Bond length
Molecular structure
1 Citation (Scopus)

Preparation of polyfunctional arylzinc organometallics in toluene by halogen/zinc exchange reactions

Balkenhohl, M., Ziegler, D. S., Desaintjean, A., Bole, L. J., Kennedy, A. R., Hevia, E. & Knochel, P., 9 Sep 2019, In : Angewandte Chemie International Edition. 58, 37, p. 12898-12902 5 p.

Research output: Contribution to journalArticle

Triazines
Halogens
Toluene
Organometallics
Ketones

Role of H‑optimization in the computed intermolecular interactions and charge-transfer integrals in diketopyrrolopyrroles

Calvo-Castro, J., Kennedy, A. R. & McHugh, C. J., 11 Apr 2019, In : Journal of Physical Chemistry A. 123, 14, p. 3185-3193 9 p.

Research output: Contribution to journalArticle

Dimers
Charge transfer
charge transfer
Atoms
X rays

Selective mono- and dimetallation of a group 3 sandwich complex

Martínez-Martínez, A. J., Kennedy, A. R., Paprocki, V., Fantuzzi, F., Dewhurst, R. D., O'Hara, C. T., Braunschweig, H. & Mulvey, R. E., 21 Aug 2019, In : Chemical Communications. 55, 65, p. 9677-9680 4 p.

Research output: Contribution to journalArticle

Scandium
Deprotonation
Lithium
Amides
Metals
Discrete Fourier transforms
Atoms
Quantum theory
Electronic structure
Anions

Taming copper(I) cyanate and selenocyanate with N-heterocyclic carbenes

Dodds, C. A., Kennedy, A. R. & Thompson, R., 12 Jul 2019, (Accepted/In press) In : European Journal of Inorganic Chemistry. 21 p.

Research output: Contribution to journalArticle

Cyanates
Copper
Crystal structure
Ligands
X rays
3 Citations (Scopus)

The electrophilic fluorination of enol esters using SelectFluor: a polar two-electron process

Wood, S. H., Etridge, S., Kennedy, A. R., Percy, J. M. & Nelson, D. J., 11 Apr 2019, In : Chemistry - A European Journal. 25, 21, p. 5574-5585 12 p.

Research output: Contribution to journalArticle

Open Access
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Fluorination
Esters
Fluorinated Steroids
Electrons
Oxygen
2018
7 Citations (Scopus)
9 Downloads (Pure)

Alkene oxyamination using malonoyl peroxides: preparation of pyrrolidines and isoxazolidines

Alamillo-Ferrer, C., Curle, J. M., Davidson, S. C., Lucas, S. C. C., Atkinson, S. J., Campbell, M., Kennedy, A. R. & Tomkinson, N. C. O., 15 Jun 2018, In : Journal of Organic Chemistry. 83, 12, p. 6728-6740 13 p.

Research output: Contribution to journalArticle

Open Access
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Pyrrolidines
Nucleophiles
Stereochemistry
Peroxides
Alkenes
1 Citation (Scopus)
Open Access
File
Ligands
Iridium
Palladium
Nickel
Silver
7 Citations (Scopus)

Application of catalyst-free Domino Mannich/Freidel-Crafts alkylation reaction for the synthesis of novel tetrahydroquinolines of potential antitumor activity

Castillo, J-C., Jiménez, E., Portilla, J., Insuasty, B., Quiroga, J., Moreno-Fuquen, R., Kennedy, A. R. & Abonia, R., 1 Mar 2018, In : Tetrahedron. 74, 9, p. 932-947 16 p.

Research output: Contribution to journalArticle

National Cancer Institute (U.S.)
Alkylation
Alkenes
Cell Cycle Checkpoints
S Phase
1 Citation (Scopus)
2 Downloads (Pure)

Atom efficient synthesis of selectively difluorinated carbocycles through a gold(I) catalyzed cyclization

McCarter, A. W., Sommer, M., Percy, J. M., Jamieson, C., Kennedy, A. R. & Hirst, D. J., 6 Jul 2018, In : Journal of Organic Chemistry.

Research output: Contribution to journalArticle

Open Access
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Acetals
Cyclization
Gold
Bearings (structural)
Trifluoroethanol
6 Citations (Scopus)
6 Downloads (Pure)

Catalytic enantioselective synthesis of α-chiral azaheteroaryl ethylamines by asymmetric protonation

Xu, C., Muir, C. W., Leach, A. G., Kennedy, A. R. & Watson, A. J. B., 1 Aug 2018, In : Angewandte Chemie International Edition.

Research output: Contribution to journalArticle

Open Access
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Ethylamines
Protonation
Aniline Compounds
Nucleophiles
Catalysts
7 Citations (Scopus)
3 Downloads (Pure)

Coinage metal complexes of selenoureas derived from N-heterocyclic carbenes

Nahra, F., Van Hecke, K., Kennedy, A. & Nelson, D. J., 30 May 2018, In : Dalton Transactions. 14 p.

Research output: Contribution to journalArticle

Open Access
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Coinage
Coordination Complexes
Silver
Copper
Ligands
24 Citations (Scopus)
21 Downloads (Pure)
Open Access
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Aluminum
Lithium
Catalysis
Ligands
Catalysts
9 Downloads (Pure)
Open Access
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formaldehyde
Formaldehyde
Dimers
insertion
Crystal structure
1 Citation (Scopus)
14 Downloads (Pure)
Open Access
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Asparagine
halides
Cations
Hydrogen bonds
Salts
17 Citations (Scopus)
18 Downloads (Pure)

Donor-influenced structure-activity correlations in stoichiometric and catalytic reactions of lithium monoamido-monohydrido-dialkylaluminates

Lemmerz, L. E., McLellan, R., Judge, N. R., Kennedy, A. R., Orr, S. A., Uzelac, M., Hevia, E., Robertson, S. D., Okuda, J. & Mulvey, R. E., 11 Jul 2018, In : Chemistry - A European Journal. 24, 39, p. 9940-9948 9 p.

Research output: Contribution to journalArticle

Open Access
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hydroboration
constitution
Ketones
Lithium
ketones
4 Downloads (Pure)

Exploiting synergistic effects in organozinc chemistry for direct stereoselective C‐glycosylation reactions at room temperature

Hernan-Gomez, A., Orr, S., Uzelac, M., Kennedy, A., Barroso, S., Jusseau, X., Lemaire, S. & Hevia, E., 1 Jun 2018, In : Angewandte Chemie International Edition.

Research output: Contribution to journalArticle

Open Access
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Zinc
Lewis Bases
Stereoselectivity
Bromides
Catalysis
43 Citations (Scopus)
28 Downloads (Pure)
Open Access
File
Triazoles
Ketones
Aldehydes
Lithium
4,4,5,5-tetramethyl(1,3,2)dioxaborolane
1 Citation (Scopus)
16 Downloads (Pure)

Mixed Ca/Sr salt forms of salicylic acid, tuning structure and aqueous solubility

Allan, P., Arlin, J-B., Kennedy, A. R. & Walls, A., 28 Feb 2018, In : Acta Crystallographica Section C: Structural Chemistry. C74, 2, p. 131-138 8 p.

Research output: Contribution to journalArticle

Open Access
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Salicylic acid
Salicylic Acid
solubility
Solubility
Tuning
6 Citations (Scopus)
1 Downloads (Pure)

Modulation of coordination in pincer-type isonicotinohydrazone Schiff base ligands by proton transfer

Mahmoudi, G., Khandar, A. A., Afkhami, F. A., Miroslaw, B., Gurbanov, A. V., Zubkov, F. I., Kennedy, A., Franconetti, A. & Frontera, A., 30 Oct 2018, In : CrystEngComm.

Research output: Contribution to journalArticle

Open Access
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Proton transfer
Schiff Bases
imines
Ligands
Modulation
2 Citations (Scopus)
11 Downloads (Pure)

Molecular manipulations of a utility nitrogen-heterocyclic carbene by sodium magnesiate complexes and transmetallation chemistry with gold complexes

Hevia, E., Hernán-Gómez, A., Uzelac, M., Baillie, S., Armstrong, D., Kennedy, A. & Fuentes, M. Á., 11 May 2018, In : Chemistry - A European Journal. 11 p.

Research output: Contribution to journalArticle

Open Access
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Gold
Nitrogen
Sodium
Ligands
Magnesium
1 Downloads (Pure)

Oxacycle fused [1]benzothieno[3,2‐b][1]benzothiophene derivatives: synthesis, electronic structure, electrochemical properties, ionisation potential, and crystal structure

Mohankumar, M., Chattopadhyay, B., Sanguinet, L., Kennedy, A. R., Lemaur, V., Cornil, J., Fenwick, O., Samori, P., Geerts, Y. & Hadji, R., 2 Oct 2018, In : ChemPlusChem.

Research output: Contribution to journalArticle

Open Access
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Ionization potential
Electrochemical properties
Electronic structure
Crystal structure
Derivatives
4 Citations (Scopus)
18 Downloads (Pure)
Open Access
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Cyclic N-Oxides
Sulfides
Chlorides
Quinolines
Pyrazines
24 Downloads (Pure)

Salt forms of sulfadiazine with alkali metal and organic cations

Campbell, G., Fisher, R., Kennedy, A. R., King, N. L. C. & Spiteri, R., 15 Mar 2018, In : Acta Crystallographica Section C: Structural Chemistry. 74, 4, p. 472-479 8 p.

Research output: Contribution to journalArticle

Open Access
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Alkali Metals
Sulfadiazine
Alkali metals
alkali metals
Anions
57 Downloads (Pure)

Scalable total synthesis and comprehensive structure–activity relationship studies of the phytotoxin coronatine

Littleson, M. M., Baker, C. M., Dalencon, A. J., Frye, E. C., Jamieson, C., Kennedy, A. R., Ling, K. B., McLachlan, M. M., Montgomery, M. G., Russell, C. J. & Watson, A. J. B., 13 Feb 2018, (Accepted/In press) In : Nature Communications. 14 p.

Research output: Contribution to journalArticle

Open Access
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Agrochemicals
synthesis
Biological Products
Libraries
acids
6 Citations (Scopus)

Structural and synthetic insights into pyridine homocouplings mediated by a β-diketiminato magnesium amide complex

Hevia, E., McLellan, R., Davin, L., Clegg, W., Kennedy, A. & Probert, M. R., 27 Jul 2018, In : Chemistry - A European Journal. 7 p.

Research output: Contribution to journalArticle

Open Access
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Amides
Pyridine
Magnesium
Thymidine Monophosphate
Pyridines
2 Citations (Scopus)
24 Downloads (Pure)

Structural study of salt forms of amides; paracetamol, benzamide and piperine

Kennedy, A. R., King, N. L. C., Oswald, I. D. H., Rollo, D. G., Spiteri, R. & Walls, A., 15 Feb 2018, In : Journal of Molecular Structure . 1154, p. 196-203 8 p.

Research output: Contribution to journalArticle

Open Access
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piperine
Acetaminophen
Amides
Salts
Protonation
2017
17 Citations (Scopus)
23 Downloads (Pure)
Open Access
File
Dihydropyridines
Alkali Metals
Alkali metals
Lithium
Hydrides
2 Citations (Scopus)
11 Downloads (Pure)

Ag(I) bipyridyl coordination polymers containing functional anions

Dodds, C. A., Hobday, C. L., Kennedy, A. R., McKellar, S. C., Smillie, K. & Walls, A., 14 Feb 2017, In : New Journal of Chemistry. 41, 4, p. 1574-1581 8 p.

Research output: Contribution to journalArticle

Open Access
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2,2'-Dipyridyl
Application programming interfaces (API)
Anions
Polymers
Coloring Agents
8 Citations (Scopus)
19 Downloads (Pure)

Aqueous solubility of organic salts. Investigating trends in a systematic series of 51 crystalline salt forms of methylephedrine

S. de Moraes, L., Edwards, D., Florence, A. J., Johnston, A., Johnston, B. F., Morrison, C. A. & Kennedy, A. R., 7 Jun 2017, In : Crystal Growth and Design. 17, 6, p. 3277-3286 10 p.

Research output: Contribution to journalArticle

Open Access
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melting points
solubility
Solubility
Melting point
Salts
6 Citations (Scopus)
15 Downloads (Pure)
Open Access
File
Cyclic Ethers
Chlorides
ethers
pyridines
chlorides
14 Downloads (Pure)
Open Access
File
Alkali Metals
Chemical activation
Thymidine Monophosphate
Organometallics
Complexation
11 Downloads (Pure)
Open Access
File
Metals
Sodium
X rays
Ether
Alkali Metals
3 Citations (Scopus)
24 Downloads (Pure)
Open Access
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tetrahydrofuran
Dimethyl Sulfoxide
esters
Esters
Hydrogen bonds
6 Citations (Scopus)
37 Downloads (Pure)

Exploring the solid state and solution structural chemistry of the utility amide potassium hexamethyldisilazide (KHMDS)

Ojeda-Amador, A. I., Martínez-Martínez, A. J., Robertson, G. M., Robertson, S. D., Kennedy, A. R. & O'Hara, C. T., 15 May 2017, In : Dalton Transactions. 46, 19, p. 6392-6403 12 p.

Research output: Contribution to journalArticle

Open Access
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Amides
Nuclear magnetic resonance spectroscopy
Amines
Potassium
Toluene
1 Citation (Scopus)
50 Downloads (Pure)
Open Access
File
Pyrroles
pyrroles
grooves
Binders
Hydrogen bonds