Crystallographic work of Olivier Blacque

ZORA Publication List

Publications

• 2024

  • Ren, Jiajun; Mathew, Anugraha; Rodríguez-García, María; Kohler, Tobias; Blacque, Olivier; Linden, Anthony; Eberl, Leo; Sieber, Simon; Gademann, Karl (2024). Functional biosynthetic stereodivergence in a gene cluster via a dihydrosydnone N-oxide. Communications Chemistry, 7(1):301.
  • Mukiza, Janvier; Habarurema, Gratien; Sezirahiga, Jurdas; Mukabagorora, Theonille; Nkuranga, Jean Bosco; Uwambajineza, Tite; Muyizere, Theoneste; Blacque, Olivier; Baziga, Gervais (2024). Aqua-complexes of pyrimidine-4,6-dicarboxylic acid and its monoester with organometallic fac-[M(CO)3]+ (M = Re and 99mTc) core as radiopharmaceutical probes: Synthesis and characterization. Journal of Organometallic Chemistry, 1021:123348.
  • Al-Wahaibi, Lamya H; Gudimetla, Seetha Rama Sastry; Blacque, Olivier; El-Emam, Ali A; Percino, M Judith; Thamotharan, Subbiah (2024). Interplay of weak noncovalent interactions in (E)-4-chloro-N’-(thiophen-2-ylmethylene)benzohydrazide: Insights from Hirshfeld surface, PIXEL energy and QTAIM analyses. Journal of Molecular Structure THEOCHEM, 1315:138822.
  • El Atrassi, Zakaria; Benzekri, Zakaria; Blacque, Olivier; Hökelek, Tuncer; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira (2024). Crystal structure, Hirshfeld surface analysis, and calculations of intermolecular interaction energies and energy frameworks of 1-[(1-hexyl-1$H$-1,2,3-triazol-4-yl)methyl]-3-(1-methylethenyl)-benzimidazol-2-one. Acta Crystallographica Section E: Crystallographic Communications, 80(10):1075-1080.
  • Sghyar, Riham; Lahyaoui, Mouad; El Ibrahimi, Brahim; Blacque, Olivier; Kartah, Badr Eddine; Ez-zoubi, Amine; Hökelek, Tuncer; Mague, Joel T; EL Hadrami, El Mestafa; Ben-Tama, Abdeslem; Sebbar, Nada Kheira (2024). Newly synthesized based Schiff of phenylferrocene: Molecular and crystal structures, Density Functional Theory calculations, Hirshfeld surface analyses, and improved molecular docking data. Journal of Molecular Structure THEOCHEM, 1314:138747.
  • Adams, Pardis; Bühler, Jan; Walz, Iva; Moehl, Thomas; Roithmeyer, Helena; Blacque, Olivier; Comini, Nicolò; Diulus, J Trey; Alberto, Roger; Siol, Sebastian; Dimitrievska, Mirjana; Novotny, Zbynek; Tilley, S David (2024). Direct Anchoring of Molybdenum Sulfide Molecular Catalysts on Antimony Selenide Photocathodes for Solar Hydrogen Production. ACS Energy Letters, 9(8):3828-3834.
  • Hosseininasab, Fatemeh S; Memarian, Hamid R; Rudbari, Hadi Amiri; Blacque, Olivier (2024). A comparative study of X-ray structural analysis, DFT computations, and Hirshfeld surface analysis for decahydroacridine-1,8-diones. Journal of the Iranian Chemical Society, 21(7):1997-2015.
  • Ferrara, Isabella; Chesnokov, Gleb A; Dittmann, Silvia; Blacque, Olivier; Sievers, Susanne; Gademann, Karl (2024). Formal Single Atom Editing of the Glycosylated Natural Product Fidaxomicin Improves Acid Stability and Retains Antibiotic Activity. JACS Au, 4(6):2267-2280.
  • Rivas, Feriannys; Del Mármol, Carolina; Scalese, Gonzalo; Pérez Díaz, Leticia; Machado, Ignacio; Blacque, Olivier; Salazar, Fabiana; Coitiño, E Laura; Benítez, Diego; Medeiros, Andrea; Comini, Marcelo; Gambino, Dinorah (2024). Multifunctional Organometallic Compounds Active against Infective Trypanosomes: Ru(II) Ferrocenyl Derivatives with Two Different Bioactive Ligands. Inorganic Chemistry, 63(25):11667-11687.
  • El Atrassi, Zakaria; Zouhair, Mustapha; Blacque, Olivier; Hökelek, Tuncer; Haoudi, Amal; Mazzah, Ahmed; Cherkaoui, Hassan; Sebbar, Nada Kheira (2024). Crystal structure, Hirshfeld surface analysis, calculations of intermolecular interaction energies and energy frameworks and the DFT-optimized molecular structure of 1-[(1-butyl-1 $H$-1,2,3-triazol-4-yl)methyl]-3-(prop-1-en-2-yl)-1$H$-benzimidazol-2-one. Acta Crystallographica Section E: Crystallographic Communications, 80(6):601-606.
  • Bühler, Jan; Muntwyler, Alissa; Roithmeyer, Helena; Adams, Pardis; Besmer, Manuel Luca; Blacque, Olivier; Tilley, S David (2024). Immobilised Ruthenium Complexes for the Electrooxidation of 5‐Hydroxymethylfurfural. Chemistry, 30(19):e202304181.
  • Bernhardt, Annika; Čavlović, Daniel; Mayländer, Maximilian; Blacque, Olivier; Cruz, Carlos M; Richert, Sabine; Juríček, Michal (2024). π‐Radical Cascade to a Chiral Saddle‐Shaped Peropyrene. Angewandte Chemie Internationale Edition, 63(14):e202318254.
  • Lin, Yan; Scalese, Gonzalo; Bulman, Christina A; Vinck, Robin; Blacque, Olivier; Paulino, Margot; Ballesteros-Casallas, Andres; Pérez Díaz, Leticia; Salinas, Gustavo; Mitreva, Makedonka; Weil, Tobias; Cariou, Kevin; Sakanari, Judy A; Gambino, Dinorah; Gasser, Gilles (2024). Antifungal and Antiparasitic Activities of Metallocene-Containing Fluconazole Derivatives. ACS Infectious Diseases, 10(3):938-950.
  • Csucker, Joshua; Decrausaz, Nathalie; Jäggi, Sarah Isabella; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger (2024). Synthesis and Photophysical Evaluation of 3,3’‐Nitrogen Bis‐Substituted $fac$‐[Re(CO)$_3$(Diimine)Br] Complexes. Helvetica Chimica Acta, 107(2):e202300239.
  • Taghizadeh Shool, Maryam; Amiri Rudbari, Hadi; Cuevas-Vicario, José V; Rodríguez-Rubio, Andrea; Stagno, Claudio; Iraci, Nunzio; Efferth, Thomas; Omer, Ejlal A; Schirmeister, Tanja; Blacque, Olivier; Moini, Nakisa; Sheibani, Esmail; Micale, Nicola (2024). Investigating the Cytotoxicity of Ru(II) Polypyridyl Complexes by Changing the Electronic Structure of Salicylaldehyde Ligands. Inorganic Chemistry, 63(2):1083-1101.
  • Roithmeyer, Helena; Sévery, Laurent; Moehl, Thomas; Spingler, Bernhard; Blacque, Olivier; Fox, Thomas; Iannuzzi, Marcella; Tilley, S David (2024). Electrocatalytic Ammonia Oxidation with a Tailored Molecular Catalyst Heterogenized via Surface Host–Guest Complexation. Journal of the American Chemical Society, 146(1):430-436.
  • Palmeira-Mello, Marcos V; Costa, Analu R; de Oliveira, Leticia P; Blacque, Olivier; Gasser, Gilles; Batista, Alzir A (2024). Exploring the potential of ruthenium (ll)-phosphine–mercapto complexes as new anticancer agents. Dalton Transactions, 53(26):10947-10960.
  • Forooghi, Kimia; Amiri Rudbari, Hadi; Stagno, Claudio; Iraci, Nunzio; Cuevas-Vicario, José V; Kordestani, Nazanin; Schirmeister, Tanja; Efferth, Thomas; Omer, Ejlal A; Moini, Nakisa; Aryaeifar, Mahnaz; Blacque, Olivier; Azadbakht, Reza; Micale, Nicola (2024). Structural features and antiproliferative activity of Pd($ \mathrm{II} $) complexes with halogenated ligands: a comparative study between Schiff base and reduced Schiff base complexes. Dalton Transactions, 53(25):10571-10591.
  • Manikandan, Balasubramaniyam; Thamotharan, Subbiah; Blacque, Olivier; Selva Ganesan, Subramaniapillai (2024). Deconstructive annulation mediated one-pot synthesis of xanthene derivatives. Organic & Biomolecular Chemistry, 22(16):3279-3286.
  • Aryaeifar, Mahnaz; Rudbari, Hadi Amiri; Moreno-Pineda, Eufemio; Cuevas-Vicario, José V; Paul, Sagar; Schulze, Michael; Wernsdorfer, Wolfgang; Lloret, Francisco; Moini, Nakisa; Blacque, Olivier (2024). Synthesis, characterization and magnetic properties of halogenated tetranuclear cubane-like nickel($ \mathrm{II}$) complexes. New Journal of Chemistry, 48(8):3603-3613.

• 2023

  • Gourdon‐Grünewaldt, Lisa; Blacque, Olivier; Gasser, Gilles; Cariou, Kevin (2023). Towards Copper(I) Clusters for Photo‐Induced Oxidation of Biological Thiols in Living Cells**. Chembiochem, 24(23):e202300496.
  • Al-Wahaibi, Lamya H; Mangaiyarkarasi, Sivashanmugam; Blacque, Olivier; Hassan, Hanan M; El-Emam, Ali A; Percino, M Judith; Thamotharan, Subbiah (2023). Unusual short intramolecular N–H⋅⋅⋅H–C contact and weak intermolecular interactions in two N-(adamantan-1-yl)piperazine carbothioamides: Crystallography, quantum chemical study and in vitro urease inhibitory activity. Journal of Molecular Structure THEOCHEM, 1291:136052.
  • Al-Omary, Fatmah A M; Blacque, Olivier; Alanazi, Fahdah S; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of 2-[(4-bromobenzyl)thio]- 5-(5-bromothiophen-2-yl)-1,3,4-oxadiazole, C$_{13}$H$_{8}$Br$_{2}$N$_{2}$OS$_{2}$. Zeitschrift für Kristallographie - New Crystal Structures, 238(5):911-913.
  • Battistin, Federica; Fernandes, Célia; Raposinho, Paula D; Blacque, Olivier; Paulo, Antonio; Alberto, Roger (2023). In vivo and in vitro studies of [M(η$^6$-pseudoerlotinib)$_2$]$^+$ sandwich complexes (M = Re, 99m$_T$$_c$). Dalton Transactions, 52(43):15757-15766.
  • Wang, Youchao; Felder, Patrick S; Mesdom, Pierre; Blacque, Olivier; Mindt, Thomas L; Cariou, Kevin; Gasser, Gilles (2023). Towards Ruthenium(II)‐Rhenium(I) Binuclear Complexes as Photosensitizers for Photodynamic Therapy. Chembiochem, 24(19):e202300467.
  • Mukiza, Janvier; Habarurema, Gratien; Nkuranga, Jean Bosco; Sezirahiga, Jurdas; Akin-Ojo, Omololu; Nkurunziza, Jean Baptiste; Kampire, Edwidge; Gakuba, Emmanuel; Blacque, Olivier (2023). Thiocyanate-induced N-activation and nucleophilic 1,2-dearomatization of pyridinedicarbonyl dichloride: a synthetic route to a novel 1,2-dihydropyridine-based heterocyclic compound. Journal of the Iranian Chemical Society, 20(10):2657-2664.
  • Al-Wahaibi, Lamya H; Blacque, Olivier; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of 4-chloro-$N$′-[(1$E$)-(2-nitrophenyl)methylidene]benzohydrazide, C$_{14}$H$_{10}$ClN$_3$O$_3$. Zeitschrift für Kristallographie - New Crystal Structures, 238(4):631-633.
  • Woods, Joseph F; Gallego, Lucía; Maisch, Amira; Renggli, Dominik; Cuocci, Corrado; Blacque, Olivier; Steinfeld, Gunther; Kaech, Andres; Spingler, Bernhard; Vargas Jentzsch, Andreas; Rickhaus, Michel (2023). Saddles as rotational locks within shape-assisted self-assembled nanosheets. Nature Communications, 14(1):4725.
  • Al-Wahaibi, Lamya H; Blacque, Olivier; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of 4-chloro-$N$′-[(1$E$)-pyridin-3-ylmethylidene]benzohydrazide, C$_{13}$H$_{10}$ClN$_3$O. Zeitschrift für Kristallographie - New Crystal Structures, 238(3):517-520.
  • Mani, Asma; Feng, Tao; Gandioso, Albert; Vinck, Robin; Notaro, Anna; Gourdon, Lisa; Burckel, Pierre; Saubaméa, Bruno; Blacque, Olivier; Cariou, Kevin; Belgaied, Jamel‐Eddine; Chao, Hui; Gasser, Gilles (2023). Structurally Simple Osmium(II) Polypyridyl Complexes as Photosensitizers for Photodynamic Therapy in the Near Infrared**. Angewandte Chemie Internationale Edition, 62(20):e202218347.
  • Bohnhoff-Müller, Sherin; Yadav, Prerna; Spingler, Bernhard; Blacque, Olivier; Zelder, Felix (2023). An Al-salen complex for the fluorometric detection of pyrophosphate in water via a disassembly approach. Journal of Porphyrins and Phthalocyanines, 27(1-4):661-669.
  • Al-Sanea, Mohammad M; Blacque, Olivier; Mohamed, Ahmed A B; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of $N$-(4-bromophenyl)-4-[3-(trifluoromethyl)phenyl]-piperazine-1-carbothioamide, C$_1$$_8$H$_1$$_7$BrF$_3$N$_3$S. Zeitschrift für Kristallographie - New Crystal Structures, 238(2):285-288.
  • Al-Wahaibi, Lamya H; Blacque, Olivier; Al-Shaalan, Nora H; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of 2-({[5-(adamantan-2-yl)-2-sulfanylidene-1,3,4-oxadiazolidin-3-yl]methyl}amino)benzonitrile, C20H22N4OS. Zeitschrift für Kristallographie - New Crystal Structures, 238(2):159-161.
  • Battistin, Federica; Fox, Thomas; Blacque, Olivier; Alberto, Roger (2023). Reactivities of [Re(η6-C6H6)(η6-C10H8)]+ and [Re(η6-C10H8)2]+ with Cyclic, Nonaromatic Polyenes. ACS Applied Bio Materials, 42(9):838-845.
  • Bolliger, Robin; Siebenmann, Lukas; Wolf, Emily; Ross, Megan; Meola, Giuseppe; Blacque, Olivier; Braband, Henrik; Alberto, Roger (2023). Exploring Rhenium Arene Piano-Stool Chemistry with [Re(η6-C6H6)(NCCH3)3]+: A Powerful Semi-Solvated Precursor. Inorganic Chemistry, 62(10):4227-4237.
  • Mahe, Capucine; Blacque, Olivier; Gasser, Gilles; Gandon, Vincent; Cariou, Kevin (2023). N-Metallocenyl Ynamides: Preparation, Reactivity, and Synthesis of ansa[3]-Ferrocenylamides. Organic Letters, 25(4):624-629.
  • Ebrahimi, Fatemeh; Memarian, Hamid Reza; Rudbari, Hadi Amiri; Blacque, Olivier (2023). Non-oxidative photoreaction of 1,3,5-triaryl-2-pyrazoline-4-ol (4-methoxy) derivatives. Journal of Photochemistry and Photobiology A: Chemistry, 435:114306.
  • Al-Wahaibi, Lamya H; Blacque, Olivier; Al-Shaalan, Nora H; Tiekink, Edward R T; El-Emam, Ali A (2023). Crystal structure of N-ethyl-4-[3-(trifluoromethyl)-phenyl]piperazine-1-carbothioamide, C14H18F3N3S. Zeitschrift für Kristallographie - New Crystal Structures, 238(1):45-47.
  • Čavlović, Daniel; Blacque, Olivier; Krummenacher, Ivo; Braunschweig, Holger; Ravat, Prince; Juricek, Michal (2023). Dimethylnonacethrene – en route to a magnetic switch. Chemical Communications, 59(50):7743-7746.
  • Al-Wahaibi, Lamya H; Alagappan, Kowsalya; Gomila, Rosa M; Blacque, Olivier; Frontera, Antonio; Percino, M Judith; El-Emam, Ali A; Thamotharan, Subbiah (2023). A combined crystallographic and theoretical investigation of noncovalent interactions in 1,3,4-oxadiazole-2-thione-N-Mannich derivatives: in vitro bioactivity and molecular docking. RSC Advances, 13(48):34064-34077.
  • Saadati, Arezoo; Amiri Rudbari, Hadi; Aryaeifar, Mahnaz; Blacque, Olivier; Correia, Isabel; Islam, Mohammad Khairul; Woschko, Dennis; Haj Hassani Sohi, Takin; Janiak, Christoph; Enamullah, Mohammed (2023). Experimental and computational studies on pseudotetrahedral nickel(ii)-(S or R)-dihalogen-salicylaldiminates with Δ- or Λ-chirality induction at-metal. CrystEngComm, 25(3):365-377.
  • Karges, Johannes; Giardini, Miriam A; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M (2023). Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical Science, 14(3):711-720.

Pagination