Publications 2022


  1. Afshari, M.; Dinari, M.; Farrokhpour, H.; Zamora, F. Imine-linked covalent organic framework with a naphthalene moiety as a sensitive phosphate ion sensing. ACS Appl. Mater. Inter. 2022, 14 (19), 22398-22406. DOI: 10.1021/acsami.1c24555.
  2. Ahmadi, H.; Plésiat, E.; Moioli, M.; Frassetto, F.; Poletto, L.; Decleva, P.; Schröter, C. D.; Pfeifer, T.; Moshammer, R.; Palacios, A.; Martin, F.; Sansone, G. Attosecond photoionisation time delays reveal the anisotropy of the molecular potential in the recoil frame. Nat. Commun. 2022, 13, 1242. DOI: 10.1038/s41467-022-28783-x.
  3. Algarra, M.; Cuevas, A. L.; Martínez de Yuso, M. V., Romero, R.; Alonso, B.; Casado, C. M.; Benavente, J. Optical and physicochemical characterizations of a cellulosic/CdSe-QDs@S-DAB5 film. Nanomaterials 2022, 12 (3), 484. DOI: 10.3390/nano12030484.
  4. Al-Haddad, A., Oberli, S., González-Vázquez, J., Bucher, M., Doumy, G., Ho, P., Krzywinski, J., Lane, T. J., Lutman, A., Marinelli, A., Maxwell, T. J., Moeller, S., Pratt, S. T., Ray, D., Shepard, R., Southworth, S. H., Vázquez-Mayagoitia, Á., Walter, P., Young, L., Picón, A., Bostedt, C. Observation of site-selective chemical bond changes via ultrafast chemical shifts. Nat. Commun. 2022, 13 (1), 7170. DOI: 10.1038/s41467-022-34670-2
  5. Almeida-Marrero, V.; Bethlehem, F.; Longo, S.; Candelaria Bertolino, M.; Torres, T.; Huskens, J.; de la Escosura, A. Tailored multivalent targeting of siglecs with photosensitizing liposome nanocarriers. Angew. Chem. Int. Edit. 2022, 61 (31), e202206900. DOI: 10.1002/anie.202206900.
  6. Alvarado, R.; Cárdenas, G.; Nogueira, J. J.; Ramos-Berdullas, N.; Mandado, M. On the permeation of polychlorinated dibenzodioxins and dibenzofurans through lipid membranes: Classical MD and hybrid QM/MM-EDA analysis. Membranes 2022, 13 (1), 28. DOI: 10.3390/membranes13010028.
  7. Ares, P.; Zamora, F. Editorial for a special issue on graphene and 2D alternative materials: From preparation to potential applications. Nano Mater. Sci. 2022, 4 (1), 1-2 DOI: 10.1016/j.nanoms.2022.02.002
  8. Asha, H.; Green, J. A.; Esposito, L.; Martinez-Fernandez, L.; Santoro, F.; Improta, R. Effect of the thermal fluctuations of the photophysics of GC and CG DNA steps: A computational dynamical study. J. Phys. Chem. B 2022, 126 (50), 10608-10621. DOI: 10.1021/acs.jpcb.2c05688.
  9. Asha, H.; Stadlbauer, P.; Martínez-Fernández, L.; Banáš, P.; Šponer, J.; Improta, R.; Esposito, L. Early steps of oxidative damage in DNA quadruplexes are position-dependent: Quantum mechanical and molecular dynamics analysis of human telomeric sequence containing ionized guanine. Int. J. Biol. Macromol. 2022, 194, 882-894. DOI: 10.1016/j.ijbiomac.2021.11.143
  10. Barreiro-Lage, D.; Nicolafrancesco, C.; Kocisek, J.; Luna, A.; Kopyra, J.; Alcamí, M.; Huber, B. A.; Martín, F.; Domaracka, A.; Rousseau, P.; Díaz-Tendero, S. Controlling the diversity of ion-induced fragmentation pathways by N-methylation of amino acids. Phys. Chem. Chem. Phys. 2022, 24, 941. DOI: 10.1039/D1CP04097A.
  11. Bello, R. Y.; Borràs, V. J.; González-Vázquez, J.; Martín, F. Electronic coherences in argon through interfering one- and two-photon ionization processes in the vicinity of Feshbach resonances. Phys. Rev. Res. 2022, 4 (4), 43028. DOI: 10.1103/physrevresearch.4.043028
  12. Biswas, K.; Urbani, M.; Sánchez-Grande, A.; Soler-Polo, D.; Lauwaet, K.; Matěj, A.; Mutombo, P.; Veis, L.; Brabec, J.; Pernal, K.; Gallego, J. M.; Miranda, R.; Écija, D.; Jelínek, P.; Torres, T.; Urgel, J. I. Interplay between π-conjugation and exchange magnetism in one-dimensional porphyrinoid polymers. J. Am. Chem. Soc. 2022, 144 (28), 12725–12731. DOI: 10.1021/jacs.2c02700.
  13. Borzęcka, W.; Pereira, P. M. R.; Fernandes, R.; Trindade, T.; Torres, T.; Tomé, J. P. C. Spherical and rod shaped mesoporous silica nanoparticles for cancer-targeted and photosensitizer delivery in photodynamic therapy. J. Mater. Chem. B 2022, 10, 3248-3259. DOI: 10.1039/D1TB02299G.
  14. Bravo, I.; Prata, M.; Torrinha, A.; Delerue-Matos, C.; Lorenzo, E.; Morais, S. Laccase bioconjugate and multi-walled carbon nanotubes-based biosensor for bisphenol A analysis. Bioelectrochemistry 2022, 144, 108033. DOI: 10.1016/j.bioelechem.2021.108033.
  15. Bruña, S.; Cuadrado, I.; Perles, J. Unexpected formation of a silicon-centered spirocyclic oligosiloxane bearing eight pendant ferrocene units. Crystals 2022, 12 (8), 1122. DOI: 10.3390/cryst12081122.
  16. Bruña, S.; Valverde-González, A.; Montero-Campillo, M. M.; Otilia Mó, O.; Cuadrado, I. Thiol-yne chemistry of diferrocenylacetylene. From synthesis and electrochemistry to theoretical studies. Dalton Trans. 2022, 51, 15412-15424. DOI: 10.1039/D2DT02378D.
  17. Caldero-Rodríguez, N. E.; Arpa, E. M.; Cárdenas, D. J.; Martínez-Fernández, L.; Jockusch, S.; Kanti Seth, S.; Corral, I.; Crespo-Hernández, C. E. 2-oxopurine riboside: A dual fluorescent analog and photosensitizer for RNA/DNA research. J. Phys. Chem. B 2022, 126 (24), 4483-4490. DOI: 10.1021/acs.jpcb.2c01113.
  18. Carrington, M. E.; Rampal, N., Madden, D. G.; O’Nolan, D.; Casati, N. P. M.; Divitini, G.; Martín-Illán, J. Á.; Tricarico, M; Cepitis, R.; Çamur, C.; Curtin, T.; Silvestre-Albero, J.; Tan, J.-C.; Zamora, F.; Taraskin, S.; Chapman, K. W.; Fairen-Jimenez, D. Sol-gel processing of a covalent organic framework for the generation of hierarchically porous monolithic adsorbents. Chem 2022, 8, 2961-2977. DOI: 10.1016/j.chempr.2022.07.013.
  19. Casellas, N. M.; Dai, G.; Xue, E. Y.; Fonseca, A.; Ng, D. K. P., García-Iglesias, M.; Torres, T. A self-assembled subphthalocyanine-based nanophotosensitiser for photodynamic therapy. Chem. Commun. 2022, 58, 669-672. DOI: 10.1039/D1CC05977G.
  20. Casellas, N. M.; Dai, G.; Xue, E. Y.; Vicente-Arana, M. J.; Ng, D. K. P.; Tomás Torres, T.; García-Iglesias, M. Porphyrin-based supramolecular nanofibres as a dynamic and activatable photosensitiser for photodynamic therapy. Biomater. Sci. 2022, 10, 3259-3267. DOI: 10.1039/D2BM00173J.
  21. Cattaneo, L.; Pedrelli, L.; Bello, R. Y.; Palacios, A.; Keathley, P. D.; Martín, F.; Keller, U. Isolating attosecond electron dynamics in molecules where nuclei move fast. Phys. Rev. Lett. 2022, 128, 063001. DOI: 10.1103/PhysRevLett.128.063001.
  22. Chambers, J. E.; Zubkov, N.; Kubánková, M.; Nixon-Abell, J.; Mela, I.; Abreu, S.; Schwiening, M.; Lavarda, G.; López-Duarte, I.; Dickens, J. A.; Torres, T.; Kaminski, C. F.; Holt, L. J.; Avezov, E.; James A. Huntington, J. A.; St George-Hyslop, P.; Kuimova, M. K.; Marciniak, S. J. Z-α1-antitrypsin polymers impose molecular filtration in the endoplasmic reticulum after undergoing phase transition to a solid state. Sci. Adv. 2022, 8, 14. DOI: 10.1126/sciadv.abm2094.
  23. Chang, K. F., Wang, H., Poullain, S. M., González-Vázquez, J., Bañares, L., Prendergast, D., Neumark, D. M., Leone, S. R. Conical intersection and coherent vibrational dynamics in alkyl iodides captured by attosecond transient absorption spectroscopy. J. Chem. Phys. 2022, 156 (11), 114304. DOI: 10.1063/5.0086775
  24. Chiarinelli, J.; Barreiro-Lage, D.; Bolognesi, P.; Richter, R.; Zettergren, H.; Stockett, M. H.; Díaz-Tendero, S.; Avaldi, L. Electron and ion spectroscopy of the cyclo-alanine-alanine dipeptide. Phys. Chem. Chem. Phys. 2022, 24, 5855. DOI: 10.1039/D1CP05811H.
  25. Ciaco, S.; Gavvala, K.; Greiner, V.; Mazzoleni, V.; Didier, P.; Ruff, M.; Martinez-Fernandez, L.; Improta, R.; Mély, Y. Thienoguanosine brightness in DNA duplexes is governed by the localization of its ππ* excitation in the lowest energy absorption band. Methods Appl Fluores. 2022, 10 (3), 0350032022. DOI: 10.1088/2050-6120/ac6ab6.
  26. Corpas, J.; Arpa, E. M.; Lapierre, R.; Corral, I.; Mauleón, P., Gómez Arrayás, R., Carretero, J. C. Interplay between the directing group and multifunctional acetate ligand in Pd-catalyzed anti-acetoxylation of unsymmetrical dialkyl-substituted alkynes. ACS Catal. 2022, 12 (11), 6596-6605. DOI: 10.1021/acscatal.2c00710.
  27. Corpas, J.; Gomez-Mendoza, M.; Ramírez-Cárdenas, J.; de la Peña O’Shea, V. A.; Mauleón, P.; Gómez Arrayás, R.; Carretero, J. C. One-metal/two-ligand for dual activation tandem catalysis: photoinduced Cu-catalyzed anti-hydroboration of alkynes. J. Am. Chem. Soc. 2022, 144 (28), 13006-13017. DOI: 10.1021/jacs.2c05805.
  28. Corpas, J., Kim-Lee, S. H., Mauleón, P., Arrayás, R. G., Carretero, J. C. Beyond classical sulfone chemistry: metal- and photocatalytic approaches for C-S bond functionalization of sulfones. Chem. Soc. Rev. 2022, 51 (15), 6774-6823. DOI: 10.1039/d0cs00535e.
  29. Corpas, J.; Mauleón, P.; Gómez Arrayás, R.; Carretero, J. C. E/Z photoisomerization of olefins as an emergent strategy for the control of stereodivergence in catalysis. Adv. Synth. Catal. 2022, 364 (8), 1348-1370. DOI: 10.1002/adsc.202200199.
  30. Corpas J.; Ponce A.; Maclean I..; Adrio J; Carretero J. C. Catalyst-controlled chemodivergent [3+3] and [3+2] formal cycloadditions of azomethine ylides with diphenylcyclopropenone. Synth. Stuttgart 2022, 54 (21), 4673-4682. DOI: 10.1055/a-1829-0262
  31. Cristóbal, C.; Gaviña, D.; Alonso, I.; Ribagorda, M.; Carlos Carretero, J. C.; del Pozo Losada, C.; Adrio, J. Catalytic enantioselective intramolecular 1,3-dipolar cycloaddition of azomethine ylides with fluorinated dipolarophiles. Chem. Commun. 2022, 58, 7805-7808. DOI: 10.1039/D2CC02902B.
  32. Daliran, S.; Oveisi, A. R.; Peng, Y.; López-Magano, A.; Khajeh, M.; Mas-Ballesté, R.; Alemán, J.; Luque R.; Garcia, H. Metal-organic framework (MOF)-, covalent-organic framework (COF)-, and porous-organic polymers (POP)-catalyzed selective C-H bond activation and functionalization reactions. Chem. Soc. Rev. 2022, 51, 7810-7882. DOI: 10.1039/D1CS00976A.
  33. de la Torre, G.; Moreno Simoni, M.; Duran-Sampedro, G.; Torres, T. Metallosupramolecular assemblies of phthalocyanines, subphthalocyanines and bodipys: Photosensitizers for visible-light induced processes. ECS Meet. Abstr. 2022, MA2022-01, 975. DOI: 10.1149/ma2022-0114975mtgabs
  34. Del Caño, R.; García-Mendiola, T.; García-Nieto, D.; Álvaro, R.; Luna, M.; Iniesta, H. A.; Coloma, R.; Diaz, C. R.; Milán-Rois, P.; Castellanos, M.; Abreu, M.; Cantón, R.; Galán, J. C.; Pineda, T.; Pariente, F.; Miranda, R.; Somoza, Á.; Lorenzo, E. Amplification-free detection of SARS-CoV-2 using gold nanotriangles functionalized with oligonucleotides. Microchim. Acta 2022, 189 (4), 171. DOI: 10.1007/s00604-022-05272-y
  35. del Río-Rodríguez, R.; Blanco, L.; Collado, A.; Fernández-Salas, J. A.; Alemán, J. Nickel-catalysed cross electrophile coupling of benzyl bromides and sulfonium salts towards the synthesis of dihydro stilbenes. Chem.-Eur. J. 2022, e202201644. DOI: 10.1002/chem.202201644.
  36. del Río-Rodríguez, R.; Fragoso-Jarillo, L.; Garrido-Castro, A. F.; Maestro, M. C.; Fernández-Salas, J. A.; Alemán, J. General electrochemical Minisci alkylation of N-heteroarenes with alkyl halides. Chem. Sci. 2022, 13, 6512-6518. DOI: 10.1039/D2SC01799G.
  37. del Río-Rodríguez, R.; Westwood, M. T.; Sicignano, M.; Juhl, M.; Fernández-Salas, J. A.; Alemán J.; Smith A.D. Isothiourea-catalysed enantioselective radical conjugate addition under batch and flow conditions. Chem. Commun. 2022, 58, 7277-7280. DOI: 10.1039/D2CC02432B.
  38. Escolano, M.; Cabrero-Afonso, M. J.; Ribagorda, M., Badir, S.O.; Molander, G. A. Nickel-mediated synthesis of non-anomeric C-acyl glycosides through electron donor-acceptor complex photoactivation. J. Org. Chem. 2022, 87, 4981-4990. DOI: 10.1021/acs.joc.1c03041
  39. Gala, J. F.; Pierre-Charles, P.-C.; Yáñez M.; Mó, O. Lewis basicity of alkyl carbonates and other esters. The Gutmann Donor Number (DN), a flawed indicator? Boron trifluoride adduct-formation enthalpy, experimentally or computationally determined, as a reliable alternative. Journal of Molecular Liquids 2022, 370, 120997. DOI: 10.1016/j.molliq.2022.120997.
  40. Ganguly, S.; Barreiro-Lage, D.; Walsh, N.; Sorensen, S. L.; Díaz-Tendero, S.; Gisselbrecht, M. The origin of enhanced O2+ production from photoionized CO2 clusters. Commun. Chem. 2022, 5, 16. DOI: 10.1038/s42004-022-00629-z.
  41. Ganguly, S.; Gisselbrecht, M.; Eng-Johnsson, P.; Feifel, R.; Hervieux, P.-A.; Alfaytarouni, Z.; Fink, R. F.; Díaz-Tendero, S.; Milosavljević, A. R.; Rousseau, P.; Maclot, S. Coincidence study of core-ionized adamantane: site-sensitivity within a carbon cage? Phys. Chem. Chem. Phys. 2022, 24, 28994-29003. DOI: 10.1039/D2CP04426A.
  42. García-Arroyo, P., Martínez-Periñán, E., Cabrera-Trujillo, J.J.; Salagre, E.; G. Michel, E.; Martínez, J. I.; Lorenzo, E.; Segura, J. L. Pyrenetetraone-based covalent organic framework as an effective electrocatalyst for oxygen reduction reaction. Nano Res. 2022, 15, 3907-3912. DOI: 10.1007/s12274-021-4043-2.
  43. Gazzeh, H.; Rouatbi, F.; Chniti, S.; Askri, M.; Knorr, M.; Strohmann, C.; Golz, C.; Lamsabhi, A. M. Chemoselective and diastereodivergent synthesis of new spirooxindolo-pyrrolizidines and pyrrolidines stemming from unsymmetrical 1,3-bis(arylidene)tetral-2-ones: a combined experimental and theoretical study. New. J. Chem. 2022 46, 19198. DOI: 10.1039/D2NJ03887K.
  44. Gimferrer, M.; Danés, S.; Vos, E.; Yildiz, C. B.; Corral, I.; Jana, A.; Salvador, P.; Andrada, D. M. The oxidation state in low-valent beryllium and magnesium compounds. Chem. Sci. 2022, 13, 6583-6591. DOI: 10.1039/D2SC01401G
  45. González-Collado, C. M.; Plésiat, E.; Decleva, P.; Palacios, A.; Martín, F. Vibrationally resolved photoelectron angular distributions of ammonia. Phys. Chem. Chem. Phys. 2022, 24, 7700-7712. DOI: 10.1039/D2CP00627H.
  46. González-Muñoz, D.; Alemán, J.; Blanco, M.; Cabrera, S. Single walled carbon nanotubes with encapsulated Pt(II) photocatalyst for the oxidation of sulfides in water. J. Catal. 2022, 413, 274-283. DOI: 10.1016/j.jcat.2022.06.027.
  47. González-Muñoz, D.; Gómez-Avilés, A.; Molina, C. B.; Bedia, J.; Belver, C.; Alemán, J.; Cabrera, S. Anchoring of 10-phenylphenothiazine to mesoporous silica materials: A water compatible organic photocatalyst for the degradation of pollutants. J. Mat. Sci. Technol. 2022, 103, 134-143. DOI: 10.1016/j.jmst.2021.07.004.
  48. Gonzalez Rodriguez, D.; Aparicio, F.; Mayoral, M. J.; Torres, T. Chiral self-recognition and self-discrimination processes in different subphthalocyanine aggregation regimes. ECS Meet. Abstr. 2022, MA2022-01, 941. DOI: 10.1149/ma2022-0114941mtgabs
  49. Grytsyk, N.; Richert, L.; Didier, P.; Dziuba, D.; Ciaco, S.; Mazzoleni, V.; Lequeu, T.; Mori, M.; Tor, Y.; Martinez-Fernandez, L.; Improta, R.; Mély, Y. Thienoguanosine, a unique non-perturbing reporter for investigating rotational dynamics of DNA duplexes and their complexes with proteins. Int. J. Biol. Macromol. 2022, 213, 210-22512022. DOI: 10.1016/j.ijbiomac.2022.05.162.
  50. Guerra, C.; Kumar, S.; Aguilar-Galindo, F.; Díaz-Tendero, S.; Lozano, A. I.; Mendes, M.; Oller, J. C.; Limao-Vieira, P.; García, G. Total electron detachment and induced cationic fragmentation cross sections for superoxide anion (O2) collisions with benzene (C6H6) molecules. Int. J. Mol. Sci. 2022, 23, 1266. DOI: 10.3390/ijms23031266.
  51. Guerrero-Corella, A.; Fraile, A.; Alemán, J. Intramolecular hydrogen-bond activation: Strategies, benefits, and influence in catalysis. ACS Org. Inorg. Au 2022, 2 (3), 197-204. DOI: 10.1021/acsorginorgau.1c00053.
  52. Guerrero-Esteban, T.; Gutierrez-Sanchez, C.; Villa-Manso, A. M.; Revenga-Parra, M.; Pariente, F.; Lorenzo, E. Sensitive SARS-CoV-2 detection in wastewaters using a carbon nanodot-amplified electrochemiluminescence immunosensor. Talanta 2022, 247, 123543. DOI: 10.1016/j.talanta.2022.123543
  53. Guillem-Navajas, A.; Martín-Illán, J. A.; Salagre, E.; Michel, E. G.; Rodriguez-San-Miguel, D., Zamora, F. Iron oxyhydroxide-covalent organic framework nanocomposite for efficient As(III) removal in water. ACS Appl. Mater. Inter. 2022, 14 (44), 50163-50170. DOI: 10.1021/acsami.2c14744.
  54. Guisán-Ceinos, S.; Rivero, A. R.; Romeo-Gella, F.; Simón-Fuente, S.; Gómez-Pastor, S.; Natalia Calvo, N.; Orrego, A. H.; Guisán, J. M.; Corral, I.; Sanz-Rodriguez, F.; Ribagorda, M. Turn-on fluorescent biosensors for imaging hypoxia-like conditions in living cells. J. Am. Chem. Soc. 2022, 144 (18), 8185-8193. DOI: 10.1021/jacs.2c01197.
  55. Gutiérrez-Gálvez, L.; del Caño, R.; Menéndez-Luque, I.; García-Nieto, D.; Rodríguez-Pena, M.; Luna, M.; Pineda, T.; Pariente, F.; García-Mendiola, T.; Lorenzo, E. Encarnación Lorenzo, E. Electrochemiluminescent nanostructured DNA biosensor for SARS-CoV-2 detection. Talanta 2022, 240, 123203. DOI: 10.1016/j.talanta.2021.123203.
  56. Gutiérrez-Sánchez, C.; Lorenzo, E. Advances on oxidase enzymes modified nanoporous carbon and gold surfaces for bioelectrochemical applications. J. Electrochem. Soc. 2022, 169, 027513 DOI: 10.1149/1945-7111/ac527b.
  57. Jiménez-Almarza, A.; López-Magano, A.; Mas-Ballesté, R.; Alemán, J. Tuning the activity-stability balance of photocatalytic organic materials for oxidative coupling reactions. ACS Appl. Mater. Inter. 2022, 14 (14), 16258-16268. DOI: 10.1021/acsami.2c01646
  58. Joseph, J.; Lourenço, L. M. O.; Tomé, J. P. C.; Torres, T.; Guldi, D. M. Unique multiphthalocyanine coordination systems: vibrationally hot excited states and charge transfer states that power high energy triplet charge separated states. Nanoscale 2022, 14 (36), 13155-13165. DOI: 10.1039/d2nr03721a
  59. Kaci, K.; del Cano, R.; Luna, M.; Milan-Rois, P.; Castellanos, M.; Abreu, M.; Canton, R.; Galan, J. C.; Somoza, Á.; Miranda, R.; Gonzalez de Rivera, G.; Garcia-Mendiola, T.; Lorenzo, E. Paving the way to point of care (POC) devices for SARS-CoV-2 detection. Talanta 2022, 247, 123542. DOI: 10.1016/j.talanta.2022.123542
  60. Kamel, E. M.; Ahmed, N.; Ajarem, J.; Allam, A.; Lamsabhi, A. M.; Mahmoud, A. Xanthine oxidase inhibitory activity of Euphorbia peplus L. phenolics. Comb. Chem. High T. Scr. 2022, 25 (8), 1336-1344. DOI: 10.2174/1386207324666210609104456
  61. Labella, J.; Durán-Sampedro, G.; Krishna, S.; Martinez-Diaz, M. V.; Guldi, D. L.; Torres, T. Anthracene-fused oligo-BODIPYs: A new class of π-extended NIR-absorbing materials. Angew. Chem. Int. Edit. 2022, e202214543. DOI: 10.1002/ange.202214543.
  62. Labella, J.; Lavarda, G.; Hernández-López, L.; Aguilar-Galindo, F.; Díaz-Tendero, S.; Lobo-Checa, J.; Torres, T. Preparation, supramolecular organization, and on-surface reactivity of enantiopure subphthalocyanines: from bulk to 2D-polymerization. J. Am. Chem. Soc. 2022. DOI: 10.1021/jacs.2c06377.
  63. Labella J.; Momblona C.; Čulík P.; López-Serrano E.; Kanda H.; Nazeeruddin M. K.; Torres T. Modulating the electron transporting properties of subphthalocyanines for inverted perovskite solar cells. Front. Chem. 2022, 10, 886522. DOI: 10.3389/fchem.2022.886522
  64. Lamsabhi, A. M.; Montero-Campillo, M.M.; Mó, O.; Yáñez, M. A theoretical survey of the UV-visible spectra of axial and peripheral substituted boron subphthalocyanines. Computation 2022, 10 (2), 14. DOI: 10.3390/computation10020014
  65. Lavarda, G.; Labella, J.; Martínez-Díaz, M. V.; Rodríguez-Morgade, M. S.; Osuka, A.; Torres, T. Recent advances in subphthalocyanines and related subporphyrinoids. Chem. Soc. Rev. 2022, 51, 9482-9619. DOI: 10.1039/D2CS00280A.
  66. Lizondo-Aranda, P.; Martinez-Fernandez, L.; Miranda, M. A.; Improta, R.; Gustavsson, T.; Lhiaubet-Vallet, V. The excited state dynamics of a mutagenic cytidine etheno adduct investigated by combining time-resolved spectroscopy and quantum mechanical calculations. J. Phys. Chem. Lett. 2022, 13 (1), 251-257. DOI: 10.1021/acs.jpclett.1c03534
  67. López, J.; Murillo, M.; Lifante-Pedrola, G.; Cantelar, E.; Gonzalez-Platas, J.; Rodríguez-Mendoza, U. R.; Amo-Ochoa, P. Multi-stimulus semiconductor Cu(I)-I-pyrimidine coordination polymer with thermo- and mechanochromic sensing. CrystEngComm 2022, 24, 341-349. DOI: 10.1039/D1CE01315G.
  68. López‐Magano, A.; Daliran, S.; Oveisi, A. R.; Mas‐Ballesté, R.; Dhakshinamoorthy, A.; Alemán, J.; Garcia, H.; Luque, R. Recent advances in the use of covalent organic frameworks as heterogeneous photocatalysts in organic synthesis. Adv. Mater. 2022, 2209475. DOI: 10.1002/adma.202209475.
  69. López‐Magano, A.; Mas‐Ballesté, R.; Alemán, J. Predesigned covalent organic frameworks as effective platforms for Pd (II) coordination enabling cross‐coupling reactions under sustainable conditions. Adv. Sustain. Sys. 2022, 6 (3), 21004095. DOI: 10.1002/adsu.202100409.
  70. López-Magano, A.; Salaverri, N.; Marzo, L.; Mas-Ballesté, R.; Alemán, J. Synergistic combination of triazine and phenanthroline moieties in a covalent triazine framework tailored for heterogeneous photocatalytic metal-free C-Br and C-Cl activation. Appl. Catal. B Environ. 2022, 317, 121791. DOI: 10.1016/j.apcatb.2022.121791
  71. Lucia-Tamudo, J.; Cárdenas, G.; Anguita-Ortiz, N.; Díaz-Tendero, S.; Nogueira, J. J. Computation of oxidation potentials of solvated nucleobases by Static and dynamic multilayer approaches. J. Chem. Inf. Model. 2022, 62, 3365-3380. DOI: 10.1021/acs.jcim.2c00234.
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