Articles

Research: 2021 (29 results)

Alakbar E. Huseynzada, Christian Jelsch, Haji Vahid N. Akhundzada, Sarra Soudani,Cherif Ben Nasr, Aygun Israyilova, Filippo Doria, Ulviyya A. Hasanova, Rana F. Khankishiyeva and Mauro Freccero
Synthesis, crystal structure and antibacterial studies of dihydropyrimidines and their regioselectively oxidized products
RSC Advances 11 (2021) 6312-6329 DOI link

Angelini G., Gansmuller A., Pécourneau J., Gasbarri C.
An insight into cyclocurcumin cis-trans isomerization: Kinetics in solution and in the presence of silver nanoparticles
Journal of Molecular Liquids 333 (2021) 116000 DOI link

Benali-Cherif R., Takouachet R., Falek W., Benali-Cherif N., Jelsch C., Merazig H., Hafied M., Bendeif E.-E., Mokhnachi N., Taibi K.
Synthesis, structural elucidation, spectroscopic, Hirshfeld surface analysis and theoretical simulation of a new adeninium orthoperiodate (1−) bis(hydrate) organic–inorganic hybrid crystals
Journal of Molecular Structure 1224 (2021) 129034 DOI link

Cuza E., Mekuimemba C. D., Cosquer N., Conan F., Pillet S., Chastanet G. and Triki S.
Spin Crossover and High-Spin State in Fe(II) Anionic Polymorphs Based on Tripodal Ligands
Inorganic Chemistry 60, 9 (2021) 6536-6549 DOI link

Fomenko I.S., Mikhailov A.A., Vorobyev V., Kuratieva N.V., Kostin G.A., Schaniel D.,Nadolinny V.A., Gushchin A.L.
Solution and solid-state light-induced transformations in heterometallic vanadium-ruthenium nitrosyl complex
Journal of Photochemistry and Photobiology, A: Chemistry 407 (2021) 113044 DOI link

Gharbi C., Fujita W., Lefebvre F., Kaminsky W., Jelsch C., Nasr C., Khedhiri L.
Synthesis, crystal structure, computational studies and spectroscopic characterization of a hybrid material self-assembly from tetra(isothiocyanate)cobalt(II) anion and 1-(4-methoxyphenyl)piperazinium
Journal of Molecular Structure 1230 (2021) 129929 DOI link

Giraud T., Bouguet-Bonnet S., Stébé M.-J., Richaudeau L., Pickaert G., Averlant-Petit M.-C. and Stefan L.
Co-assembly and multicomponent hydrogel formation upon mixing nucleobase-containing peptides
Nanoscale 13 (2021) 10566-10578 DOI link

Huseynzada A.E., Jelsch C., Akhundzada H.N., Soudani S., Ben Nasr C., Doria F., Hasanova U.A., Freccero M., Gakhramanova Z., Ganbarov K. and Najafov B.
Synthesis, crystal structure and antibacterial studies of 2,4,6-trimetoxybenzaldehyde based dihydropyrimidine derivatives
Journal of Molecular Structure 130678 (2021) DOI link

I. Kibalin, A. B. Voufack, M. Souhassou, B. Gillon, J.-M. Gillet, N. Claiser, A. Gukasov, F. Porcher and C. Lecomte
Spin-resolved atomic orbital model refinement for combined charge and spin density analysis: application to the YTiO3 perovskite
Acta Crystallographica, Section A: Foundations of Crystallography A77 (2021) DOI link

Jha, K. K., Gruza, B., Chodkiewicz, M. L., Jelsch, C., & Dominiak, P. M.
Refinements on electron diffraction data of β-glycine in MoPro: a quest for an improved structure model
Journal of Applied Crystallography 54 (2021) 1234-1243 DOI link

Khedhiri, L., Gannouni, A., Kahlaoui, M., Jelsch, C., Ferretti, V., Lefebvre, F., & Nasr, C. B.
Structural, NMR, IR, Hirshfeld surface, electrochemical and in vitro biochemical investigations of a new organic cyclohexaphosphate,(C 6 H 6 ClFN) 4 (Li) 2 (P 6 O 18)(H 2 O) 4.
Journal of the Iranian Chemical Society 18 (2021) 933-947 DOI link

Klai K., Jelsch C., Wenger E., Lefebvre F., Nasr C. B. and Kaabi K.
Synthesis, crystal structure, Hirshfeld surface analysis and characterization of a new Cd (II) complex with the 4, 4?-dimethyl-2, 2?-dipyridine monodentate ligand
Journal of the Iranian Chemical Society (2021) 1-11 DOI link

Mikhailov A. A. , Woike T., Gansmuller A., Schaniel D., Kostin G. A.
Photoinduced linkage isomers in a model ruthenium nitrosyl complex: Identification and assignment of vibrational modes
Spectrochimica Acta, Part A: Molecular Spectroscopy 263 (2021) 120217 DOI link

Mikhailov A. A., Komarov V. Yu. , Pishchur D. P., Schaniel D. and Kostin G. A.
Nitrosyl linkage photoisomerization in heteroleptic fluoride ruthenium complexes derived from labile nitrate precursors
New Journal of Chemistry 45 (2021) 8192-8202 DOI link

Milasinovic V., Molcanov K., Krawczuk A., Bogdanov N. E., Zakharov B. A., Boldyreva E. V., Jelsch C. and Kojic-Prodic, B.
Charge density studies of multicentre two-electron bonding of an anion radical at non-ambient temperature and pressure
IUCrJ 8(4) (2021) 644-654 DOI link

Nespolo M., Benahsene A.H.
Symmetry and chirality in crystals.
Journal of Applied Crystallography (in press) DOI link

Peluso P., Dessì A., Dallocchio R., Sechi B., Gatti C., Chankvetadze B., Mamane V., Weiss R., Pale P., Aubert E., Cossu S.
Enantioseparation of 5,5'-Dibromo-2,2'-Dichloro-3-Selanyl-4,4'-Bipyridines on Polysaccharide-Based Chiral Stationary Phases: Exploring Chalcogen Bonds in Liquid-Phase Chromatography
Molecules 26 (2021) 221 DOI link

Perrot T., Schwartz M., Deroy A., Girardet J.-M., Kohler A., Morel-Rouhier M., Favier F., Gelhaye E., Didierjean C.
Diversity of Omega Glutathione Transferases in mushroom-forming fungi revealed by phylogenetic, transcriptomic, biochemical and structural approaches
Fungal Genetics and Biology 148 (2021) 103506 DOI link

Pillet S.
Spin-crossover materials: Getting the most from x-ray crystallography
Journal of Applied Physics 129 (2021) 181101 DOI link

Reeves M., Tailleur E., Wood P., Marchivie M., Chastanet G., Guionneau P., Parsons S.
Mapping the cooperativity pathways in spin crossover complexes
Chemical Science 12 (2021) 1007-1015 DOI link

Rjiba A., Khoder H., Jelassi J., Bouguet-Bonnet S., Gardiennet C., Bendeif E.-E., Gansmuller A., Dorbez-Sridi R.
Differential scanning calorimetry and NMR study of water confined in a mesoporous bioactive glass
Microporous and Mesoporous Materials 316 (2021) 110992 DOI link

Saidi L., Samet A., Dammak T., Pillet S. and Abid Y.
Down and up conversion luminescence of the lead-free organic metal halide material: (C9H8NO)2SnCl6?2H2O
Physical Chemistry Chemical Physics 23 (2021) 15574-15581 DOI link

Setifi Z., Ferjani H., Jelsch C., Glidewell C., Dege N., Setifi F.
Synthesis, Structure and Hirshfeld Surface Analysis of a New Iron Complex [Fe(N4Py)(tcnspr)] (tcnspr)
(2021) 1-8 DOI link

Souhassou M., Kiblin I., Deutsch M., Voufack A. B., Lecomte C. and Claiser N.
Spin-resolved charge density and wavefunction refinements using MOLLYNX: a review
Acta Crystallographica, Section B: Structural Science 77 (2021) 706-714 DOI link

Spina R., Saliba S., Dupire F., Ptak A., Hehn A., Piutti S., Poinsignon S., Leclerc S., Bouguet-Bonnet S. and Laurain-Mattar D.
Molecular Identification of Endophytic Bacteria in Leucojum aestivum In Vitro Culture, NMR-Based Metabolomics Study and LC-MS Analysis Leading to Potential Amaryllidaceae Alkaloid Production
International Journal of Molecular Sciences 22(4) (2021) 1173 DOI link

Takouachet R., Benali-Cherif R., Bendeif E.-E., Jelsch C., Yahia Cherif F., Rahmouni A., Benali-Cherif N.
The supramolecular behavior and molecular recognition of adeninium cations on anionic hydrogen selenite/diselenite frameworks: A structural and theoretical analysis
Journal of Molecular Structure 1229 (2021) 129836 DOI link

Tchana Kamgne D., Thiodjio Sendja B., Oliveira de Souza D., Schaniel D., Aquilanti G.
An experimental XAS and ab initio approach to describe the electronic and local structure of sodium nitroprussiate single crystals
Journal of Molecular Structure 1245 (2021) 131119 DOI link

Vuillemin M., Muniglia L., Linder M., Bouguet-Bonnet S., Poinsignon S., Dos Santos Morais R., Simard B., Paris C., Michaux F., Jasniewski J.
Polymer functionalization through an enzymatic process: Intermediate products characterization and their grafting onto gum Arabic
International Journal of Biological Macromolecules 169 (2021) 480-491 DOI link

Vuković V., Leduc T., Jelić-Matošević Z., Didierjean C., Favier F., Guillot B. and Jelsch C.
A rush to explore protein-ligand electrostatic interaction energy with Charger.
Acta Crystallographica, Section D: Biological Crystallography D77 (2021) 1292-1304 DOI link

Review or popularization 2021 (4 results)

Nespolo M.
Comment on the article "The Cambridge Structural Database in chemical education: analysis of hydrogen-bonded networks in salts of hexaaqua metal ions with organic counter-ions"
Journal of Applied Crystallography 54 (2021) 707-707 Electronic reprint DOI link

Nespolo M.
Introduction to crystallography. By Frank Hoffmann.
Acta Crystallographica, Section A: Foundations of Crystallography 77 (2021) 235-238 Electronic reprint DOI link

Nespolo M.
"International Tables for Crystallography. Crystallographic symmetry. Teaching Edition". Edited by Mois I. Aroyo
Acta Crystallographica, Section A: Foundations of Crystallography 77 (2021) 506-508 Electronic reprint DOI link

Nespolo M.
"Numerical Problems in Crystallography". By M.A. Wahab.
Acta Crystallographica, Section A: Foundations of Crystallography (in press)

Revue ou chapitre d'ouvrage 2021 (3 results)

Nespolo M.
From Bond Strength to Charge Distribution: modern developments of the empirical analysis of crystal structures.
Physical Sciences Reviews (in press)

Nespolo M.
Pyroxenes. In Encyclopedia of Geology, Second edition, edited by Scott Elias and David Alderton. Elsevier.
1 (2021) 287-296 DOI link

Nespolo M.
Mathematical Crystallography and Chirality
Suurikagaku (Mathematical Sciences) 59 (2021) 24-31