Lattice vibrations of {\gamma}- and \b{eta}-coronene from Raman and theory

Authors: Bannister, Nicola, Skelton, Jonathan, Kociok-Kohn, Gabriele, Batten, Tim, Da Como, Enrico, Crampin, Simon

Source: Phys. Rev. Materials 3, 125601 (2019)

Subject Terms: Condensed Matter - Materials Science, Condensed Matter - Mesoscale and Nanoscale Physics

Access URL: http://arxiv.org/abs/1910.04101

Impact of substituent's position on the DSSC performances of new 1, 1′-bis-(diphenylphosphino)ferrocene appended nickel(ii) methoxy cyanodithiolatesElectronic supplementary information (ESI) available. CCDC 2271076–2271078. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d3ce00621b

Authors: Srivastava, Devyani, Kushwaha, Aparna, Kociok-Köhn, Gabriele, Gosavi, Suresh W., Chauhan, Ratna, Ashokkumar, Muthupandian, Kumar, Abhinav, Muddassir, Mohd.

Source: CrystEngComm. 25(40):5660-5672

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BINOL as a Chiral Solvating Agent for Sulfiniminoboronic Acids

Authors: Groleau, Robin R., Chapman, Robert S. L., Lowe, John P., Lyall, Catherine L., Kociok-Köhn, Gabriele, James, Tony D., Bull, Steven D.

Source: ANALYTICAL CHEMISTRY -WASHINGTON DC-. 95(46):16801-16809

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Polymers from sugars and isothiocyanates: ring-opening copolymerization of a d-xylose anhydrosugar oxetaneElectronic supplementary information (ESI) available: Experimental procedures; catalyst screening data; spectroscopic and crystallographic data for C1; SEC traces, spectroscopic (NMR, MALDI-ToF MS) and thermal (TGA, DSC) data for the polymers; degradation and metal coordination data. CCDC 2253111. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d3py00443k

Authors: Clark, Ella F., Kociok-Köhn, Gabriele, Davidson, Matthew G., Buchard, Antoine

Source: Polymer chemistry. 14(23):2838-2847

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Copper(ii) and cobalt(iii) Schiff base complexes with hydroxy anchors as sensitizers in dye-sensitized solar cells (DSSCs)Electronic supplementary information (ESI) available. CCDC 2202408. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d3ra00344b

Authors: Gautam, Chiteri, Srivastava, Devyani, Kociok-Köhn, Gabriele, Gosavi, Suresh W., Sharma, Vinod K., Chauhan, Ratna, Late, Dattatray J., Kumar, Abhinav, Muddassir, Mohd.

Source: RSC advances. 13(13):9046-9054

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100180475714.0x000001&indx=1&recIds=ETOCvdc_100180475714.0x000001

Approach to Di/Triorganotin(IV) Cations via Hydrolysis of Stannate Salts Bearing Alkanesulfonate Ligands

Authors: Shankar, Ravi, Chauhan, Priyanka, Jakhar, Ekta, Dubey, Archishmati, Kociok-Köhn, Gabriele

Source: Inorganic chemistry. 62(5):2181-2187

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New heteroleptic 1, 2-bis(diphenylphosphino)ethane appended cobalt(iii) ferrocene dithiocarbamates as sensitizers in dye-sensitized solar cells (DSSCs)Electronic supplementary information (ESI) available. CCDC 2208401 and 2208402. For ESI and crystallographic data in CIF or other electronic format, see DOI: https://doi.org/10.1039/d2nj04736e

Authors: Srivastava, Devyani, Singh, Amita, Kociok-Köhn, Gabriele, Gosavi, Suresh W., Chauhan, Ratna, Ashokkumar, Muthupandian, Kumar, Abhinav, Muddassir, Mohd.

Source: New journal of chemistry. 47(13):6420-6432

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Persistent azulene α-carbocations: synthesis from aldehydes, spectroscopic and crystallographic propertiesElectronic supplementary information (ESI) available: NMR spectra, X-ray crystallographic data. CCDC 2129310–2129315. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d2ob01695h

Authors: Harabajiu, Catajina, Hann, Jodie L., Murfin, Lloyd C., Kociok-Köhn, Gabriele, Lewis, Simon E.

Source: Organic & biomolecular chemistry. 21(4):858-866

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100178292501.0x000001&indx=1&recIds=ETOCvdc_100178292501.0x000001

Variations around the presence and position of sulfur in sugar-derived cyclic monomers: influence on polymerisation thermodynamics, polymer sequence and thermal propertiesDedicated to Dominique Zann, an inspiring teacher, on the occasion of her retirement.Electronic supplementary information (ESI) available: Experimental and computational details; spectroscopic and crystallographic data for 1–5; SEC traces, spectroscopic and thermal (TGA, DSC, DMA) data for the polymers; DFT calculations data and associated digital repositories. CCDC 2089243, 2095960 and 2177255–2177257. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d2py01366e

Authors: Hardy, Craig, Kociok-Köhn, Gabriele, Buchard, Antoine

Source: Polymer chemistry. 14(5):623-632

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100178309001.0x000001&indx=1&recIds=ETOCvdc_100178309001.0x000001

Unravelling the role of –OCH3 positional isomerism and dihedral angle in Ni(II)-dppe dithiolates for enhanced heterogeneous electrocatalytic oxygen evolution reaction (OER).

Authors: Srivastava, Devyani, Kushwaha, Aparna, Chauhan, Ratna, Gosavi, Suresh W., Ahmed, Sarfaraz, Kociok-Köhn, Gabriele, Kumar, Abhinav

Source: CrystEngComm; 3/14/2025, Vol. 27 Issue 10, p1460-1473, 14p

Subject Terms: CARBON electrodes, OXYGEN evolution reactions, METHOXY group, DIHEDRAL angles, SINGLE crystals, LIGANDS (Chemistry)

New di-n-butyltin(iv)-bis-(1-alkoxy-isoquinoline-4-nitrile thiolate): crystallographic and computational studiesElectronic supplementary information (ESI) available: CCDC 2124711 and 2124712. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d2ce00536k

Authors: Singh, Amita, Singh, Ayushi, Srivastava, Devyani, Kociok-Köhn, Gabriele, Köhn, Randolf D., Kumar, Abhinav, Muddassir, Mohd.

Source: CrystEngComm. 24(23):4274-4282

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Phase-controlled solvothermal syntheses and oxygen evolution reaction (OER) activity of nickel sulfide nanoparticles obtained from 1, 2-bis(diphenylphosphino)ethane nickel(ii) acetylacetonatedithiolateElectronic supplementary information (ESI) available. CCDC 2144697. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d2nj01177h

Authors: Singh, Ayushi, Singh, Amita, Kociok-Köhn, Gabriele, Chauhan, Ratna, Gosavi, Suresh W., Singh, Anar, Singh, Ashish Kumar, Kumar, Abhinav, Muddassir, Mohd.

Source: New journal of chemistry. 46(21):10246-10255

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100151363678.0x000001&indx=1&recIds=ETOCvdc_100151363678.0x000001

UV degradation of poly(lactic acid) materials through copolymerisation with a sugar-derived cyclic xanthateElectronic supplementary information (ESI) available: Experimental details; spectroscopic and crystallographic data for 1; SEC traces, spectroscopic and thermal (TGA, DSC) data for the polymers; CCDC 2089243. For ESI and crystallographic data in CIF or other electronic format see DOI: https://doi.org/10.1039/d2cc01322c

Authors: Hardy, Craig, Kociok-Köhn, Gabriele, Buchard, Antoine

Source: Chemical communications. 58(36):5463-5466

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100148592423.0x000001&indx=1&recIds=ETOCvdc_100148592423.0x000001

Control of polymorphism in coronene by the application of magnetic fields

Authors: Potticary, Jason, Terry, Lui R., Bell, Christopher, Collins, Andrew M., Fontanesi, Claudio, Kociok-Kohn, Gabriele, Crampin, Simon, Da Como, Enrico, Hall, Simon R.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/1509.04120

Catalyst speciation and deactivation in the ruthenium-mediated transformation of ethynyl-β-ionol to α,β-unsaturated esters for vitamin A synthesis.

Authors: Saib, Asad, Goy, Roman, Medlock, Jonathan, Wüstenberg, Bettina, Kociok-Köhn, Gabriele, Lyall, Catherine L., Lowe, John P., Hintermair, Ulrich

Source: Catalysis Science & Technology; 1/21/2025, Vol. 15 Issue 2, p355-375, 21p

Reversible formation of tetraphenylpentalene, a room temperature stable antiaromatic hydrocarbon.

Authors: Sanderson, Hugh J., Helbig, Andreas, Kociok-Köhn, Gabriele, Helten, Holger, Hintermair, Ulrich

Source: Chemical Science; 1/14/2025, Vol. 16 Issue 2, p952-961, 10p

On the nature and interplay of Hg⋯O/S spodium bonding and O⋯S chalcogen bonding in one-dimensional phenylmercury(II) 3-alkoxycyclobutene-1,2-dione-4-thiolate coordination polymers.

Authors: Kushwaha, Aparna, Srivastava, Devyani, Kociok-Köhn, Gabriele, Ahmed, Sarfaraz, Tiekink, Edward R. T., Kumar, Abhinav

Source: CrystEngComm; 1/7/2025, Vol. 27 Issue 1, p64-80, 17p

Subject Terms: CHARGE exchange, COMPUTATIONAL chemistry, ELECTRON pairs, ATOMS in molecules theory

Loganin-type iridoids as chemotaxonomic markers in Glandularia gooddingii (Briq.) Solbrig

Authors: Ahmed, Mai A.M., Mohamed, Nesma M., Woodman, Timothy J., Kociok-Köhn, Gabriele, Blagbrough, Ian S.

Source: Phytochemistry letters. 44:68-73

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100139413360.0x000001&indx=1&recIds=ETOCvdc_100139413360.0x000001

Ferrocenyl thiazolidine-2-thione ornamented 1D coordination polymers derived from coinage metal halides and pseudohalidesElectronic supplementary information (ESI) available. CCDC 2069828, 2105377 and 2105378. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/d1ce01147b

Authors: Singh, Ayushi, Trivedi, Manoj, Kociok-Köhn, Gabriele, Singh, Ashish Kumar, Muddassir, Mohd., Kumar, Abhinav

Source: CrystEngComm. 23(44):7794-7804

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100133962593.0x000001&indx=1&recIds=ETOCvdc_100133962593.0x000001

Azulene-based fluorescent chemosensor for adenosine diphosphateElectronic supplementary information (ESI) available: Synthetic details, fluorescence data, NMR spectra. All data generated in this project are available in the ESI. CCDC 2095982 and 2095983. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/d1cc04122c

Authors: López-Alled, Carlos M., Park, Sang Jun, Lee, Dong Joon, Murfin, Lloyd C., Kociok-Köhn, Gabriele, Hann, Jodie L., Wenk, Jannis, James, Tony D., Kim, Hwan Myung, Lewis, Simon E.

Source: Chemical communications. 57(81):10608-10611

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100131830806.0x000001&indx=1&recIds=ETOCvdc_100131830806.0x000001