Acta Crystallographica Section C-Structural Chemistry

Papers
(The TQCC of Acta Crystallographica Section C-Structural Chemistry is 2. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2020-05-01 to 2024-05-01.)
ArticleCitations
First COVID-19 molecular docking with a chalcone-based compound: synthesis, single-crystal structure and Hirshfeld surface analysis study22
Halogen bonds, chalcogen bonds, pnictogen bonds, tetrel bonds and other σ-hole interactions: a snapshot of current progress18
Anthelmintic flavonoids and other compounds from Combretum glutinosum Perr. ex DC (Combretaceae) leaves12
77Se and 125Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals10
Crystal structure of monoclinic hafnia (HfO2) revisited with synchrotron X-ray, neutron diffraction and first-principles calculations8
Crystal structure and optical properties of a two-sited EuIIIcompound: an EuIIIion coordinated by two [EuIII(DOTA)]−complexes (DOTA is 1,4,7,10-tetraazacycl7
Crystallographic evidence for unintended benzisothiazolinone 1-oxide formation from benzothiazinones through oxidation7
Bulk polarity of 3,5,7-trinitro-1-azaadamantane mediated by asymmetric NO2(lone pair)...NO2(π-hole) supramolecular bonding6
Crystal structures of salts of bedaquiline6
The reaction of thiourea and 1,3-dimethylthiourea towards organoiodines: oxidative bond formation and halogen bonding6
Synthesis, structural characterization, and electronic structure of the novel Zintl phase Ba2ZnP26
Intermolecular interactions and disorder in six isostructural celecoxib solvates6
Regio- and stereospecific assembly of dispiro[indoline-3,3′-pyrrolizine-1′,5′′-thiazolidines] from simple precursors using a one-pot procedure: synthesis, spectroscopic and structural characterization5
Psilocybin: crystal structure solutions enable phase analysis of prior art and recently patented examples5
A new bioactive cocrystal of coumarin-3-carboxylic acid and thiourea: detailed structural features and biological activity studies5
Crystal structure refinements of stoichiometric Ni3Se2 and NiSe5
Crystal structure of potassium chloride monohydrate: water intercalation into the B1 structure of KCl under high pressure5
Concomitant polymorphic forms of 3-cyclopropyl-5-(2-hydrazinylpyridin-3-yl)-1,2,4-oxadiazole5
The effect of cation–π interactions on the stability and electronic properties of anticancer drug Altretamine: a theoretical study5
Albofungin and chloroalbofungin: antibiotic crystals with 2D but not 3D isostructurality5
Deep hydration of an Li7–3x La3Zr2 M III 4
Trithiocyanuric acid: novel cocrystals and analysis of its tautomeric forms4
Δ9-Tetrahydrocannabinolic acid A, the precursor to Δ9-tetrahydrocannabinol (THC)4
Structural analysis of interpenetrated methyl-modified MOF-5 and its gas-adsorption properties4
Crystal structure and photoreactivity of a halogen-bonded cocrystal based upon 1,2-diiodoperchlorobenzene and 1,2-bis(pyridin-4-yl)ethylene4
4-Styrylquinolines from cyclocondensation reactions between (2-aminophenyl)chalcones and 1,3-diketones: crystal structures and regiochemistry4
Low-temperature phases of dicalcium barium hexakis(propanoate)4
Halobismuth(III) salts with substituted aminopyridinium cations4
New solvates and a salt of the anti-HIV compound etravirine4
Varying degrees of homostructurality in a series of cocrystals of antimalarial drug 11-azaartemisinin with salicylic acids4
A new monoclinic structure type for ternary gallide MgCoGa24
Synthesis and characterization of the Anderson–Evans tungstoantimonate [Na5(H2O)18{(HOCH2)2CHNH3}2][SbW6O244
Experimental and theoretical investigations on a furan-2-carboxamide-bearing thiazole: synthesis, molecular characterization by IR/NMR/XRD, electronic characterization by DFT, Hirshfeld surface analys4
Insights on structure and interactions of 2-amino-4-methoxy-6-methylpyrimidinium salts with 4-aminosalicylate and 5-chlorosalicylate: a combined experimental and theoretical charge–density analysis4
Crystallographic studies of piperazine derivatives of 3-methyl-5-spirofluorenehydantoin in search of structural features of P-gp inhibitors4
Structure determination of riboflavin by synchrotron high-resolution powder X-ray diffraction4
Tracking the dissolution–recrystallization structural transformation (DRST) of copper(II) complexes: a combined crystallographic, mass spectrometric and DFT study4
LaTe1.82(1): modulated crystal structure and chemical bonding of a chalcogen-deficient rare earth metal polytelluride4
Conformational analysis of two new organotin(IV) structures completed with a CSD survey4
Synthesis, structure and computational study of 5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-amine (Pesta) and its heterometallic π,σ-complex [Cu2FeCl2(Pesta)4
Synthesis, crystal structure and luminescence properties of a new samarium borate phosphate, CsNa2Sm2(BO3)(PO4)23
Crystal structure characterization and electronic structure of a rare-earth-containing Zintl phase in the Yb–Al–Sb family: Yb3AlSb33
High-resolution structural study on pyridin-3-yl ebselen and its N-methylated tosylate and iodide derivatives3
Salts of purine alkaloids caffeine and theobromine with 2,6-dihydroxybenzoic acid as coformer: structural, theoretical, thermal and spectroscopic studies3
Crystal structure, electronic structure, and optical properties of the novel Li4CdGe2S7, a wide-bandgap quaternary sulfide with a polar structure derived from lonsdale3
Crystal structure of a calcium(II)–pyrroloquinoline quinone (PQQ) complex outside a protein environment3
Synthesis and spectroscopic and structural characterization of three new 2-methyl-4-styrylquinolines formed using Friedländer reactions between (2-aminophenyl)chalcones and acetone3
Crystal structure, thermal properties and detonation characterization of bis(5-amino-1,2,4-triazol-4-ium-3-yl)methane dinitrate3
Syntheses and crystal structures of new naphthalene– and anthracene–vanadate salts and an unprecedented dimetallabis(anthracene) sandwich complex: [Na(tetrahydrofuran)3][V2(anthr3
Structural investigations into a new polymorph of F4TCNQ: towards enhanced semiconductor properties3
Bis(2-nitrophenyl) selenide, bis(2-aminophenyl) selenide and bis(2-aminophenyl) telluride: structural and theoretical analysis3
Synthesis, crystal structure and docking studies of tetracyclic 10-iodo-1,2-dihydroisoquinolino[2,1-b][1,2,4]benzothiadiazine 12,12-dioxide and its precursors3
(E,E)-1,1′-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) is3
Synthesis, structural, characterization and Hirshfeld analysis of a bisselenide and a zinc complex of a new hemilabile ferrocenylbisphosphane, [Fe{C5H4P(C6H43
Ionic cocrystals of dithiobispyridines: the role of I...I halogen bonds in the building of iodine frameworks and the stabilization of crystal structures3
Crystal structure and Hirshfeld surface analysis of the elusive trichlorobis(diethyl ether)oxomolybdenum(V)3
A new langbeinite-type phosphate K2GdHf(PO4)3: synthesis, crystal structure, band structure and luminescence properties3
Structures of five salt forms of disulfonated monoazo dyes3
Crystallographic study of the energetic salt 1,2,4-triazolium perchlorate3
A 35-year-old mystery solved: a facile synthetic route and structural confirmation of tetrachlorobis(diethyl ether)tungsten(IV)3
Two monosodium salt hydrates of Colour Index Pigment Red 483
The α-D-anomer of 2′-deoxycytidine: crystal structure, nucleoside conformation and Hirshfeld surface analysis3
Synthesis, crystal structure, and electronic structure of Li2PbSiS4: a quaternary thiosilicate with a compressed chalcopyrite-like structure3
Alkali metal salts of 4-hydroxybenzoic acid: a structural and educational study3
A new family of lanthanide coordination polymers based on 3,3′-[(5-carboxylato-1,3-phenylene)bis(oxy)]dibenzoate: synthesis, crystal structures and magnetic and luminescence properties3
A cadmium(II) coordination polymer with a fivefold interpenetrating diamondoid three-dimensional framework: synthesis, crystal structure, luminescence and photocatalytic properties3
Halogen, chalcogen, and hydrogen bonding in organoiodine cocrystals of heterocyclic thiones: imidazolidine-2-thione, 2-mercaptobenzimidazole, 2-mercapto-5-methylbenzimidazole, 2-mercaptobenzoxazole, a3
Co-operative halogen bonds and nonconventional sp-C—H...O hydrogen bonds in 1:1 cocrystals formed between diethynylpyridines and N-halosuccinimides3
Supramolecular interactions in salts/cocrystals involving pyrimidine derivatives of sulfonate/carboxylic acid3
Competition between chalcogen and halogen bonding assessed through isostructural species2
Ammonium bis(salicylaldehyde thiosemicarbazonato)ferrate(III), a supramolecular material containing low-spin FeIII2
Crystal structure, thermal properties and detonation characterization of bis(5-amino-1,2,4-triazol-4-ium-3-yl)methane dichloride2
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities2
Synthesis, structure and biological activity of four new picolinohydrazonamide derivatives2
Carbon-atom hybridization tunes the halogen-bond strength in the series of DABCO·C2H2n I2 (n = 0–2) cocrystals2
A homochiral coordination polymer of cobalt(II) and L-serine2
Structural, spectroscopic and DFT theoretical studies of phosphorescent CuIP2S-containing cuprous complexes2
The relationship between Hirshfeld potential and cytotoxic activity: a study along a series of flavonoid and chromanone derivatives2
A novel three-dimensional tetranuclear CoII coordination polymer with water hexamers based on the V-shaped tetracarboxylate ligand 4-(2,4-dicarboxylatophenoxy)phthalate2
A new two-dimensional cadmium(II) coordination polymer based on Cd6(CHADC)6 clusters (H2CHADC is cyclohexane-1,2-dicarboxylic acid): synthesis, structure and propertie2
Ab initio calculation of mechanical, electronic and optical characteristics of chalcogenide perovskite BaZrS3 at high pressures2
Can we trust the experiment? Anisotropic displacement parameters in 1-(halomethyl)-3-nitrobenzene (halogen = Cl or Br)2
Synthesis and characterization of the `Japanese rice-ball'-shaped Molybdenum Blue Na4[Mo2O2(OH)4(C6H4NO2)2]2
Fourfold alkyl wrapping of a copper(II) porphyrin thwarts macrocycle π–π stacking in a compact supramolecular package2
The crystalline forms of nine hydrochloride salts of substituted tryptamines2
Synthesis, and spectroscopic and structural characterization of three new styrylquinoline–benzimidazole hybrids2
Synthesis, X-ray structure, antimicrobial activity, DFT and molecular docking studies of N-(thiophen-2-ylmethyl)thiophene-2-carboxamide2
Synthesis, crystal structure and bioactivities of α-asaronol2
Syntheses and solid-state structures of two cofacial (bis)dipyrrin dichromium complexes in different charge states2
Two new CdII MOFs of 1,4-bis(1H-benzimidazol-1-yl)butane and flexible dicarboxylate ligands: luminescence sensing towards Fe3+2
Complexes of 2,4,6-trihydroxybenzoic acid: effects of intramolecular hydrogen bonding on ligand geometry and metal binding modes2
Chalcogen bonding in the solid-state structures of 1,3-bis(benzimidazoliumyl)benzene-based chalcogen-bonding donors2
A new three-dimensional cadmium(II) coordination polymer based on bis[4-(2-methylimidazol-1-yl)phenyl]methanone: synthesis, structure and properties2
Synthesis, structure and in vitro biological properties of a new copper(II) complex with 4-{[3-(pyridin-2-yl)-1H-pyrazol-1-yl]methyl}benzoic acid2
New red phosphor Na3EuB8O15 with an open-window tubular structure2
Pathological crystal structures2
Chemical characterization, absolute configuration and optical purity of (1S)-(+)- and (1R)-(–)-10-camphorsulfonic acid2
A comparison of three crystalline forms of miconazole: solvent-free, ethanol monosolvate and hemihydrate2
Reactivity trends of cobalt(III) complexes towards various amino acids based on the properties of the amino acid alkyl chains2
A new ladder-type silver(I) coordination polymer with 4,4′-bipyridine and 4-[(4-carboxybenzyloxy)methyl]benzoate ligands: synthesis, crystal structure, fluorescence properties and Hirshfeld surface an2
Salt formation, hydrogen-bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules2
SHG in a centrosymmetric crystal – can it be possible?2
A rare case of a 2:2:1 ternary cocrystal of pyridine sulfides and trithiocyanuric acid2
Self-assembly of a cobalt(II)-based metal–organic framework as an effective water-splitting heterogeneous catalyst for light-driven hydrogen production2
Effects of electron-donating ability of binding sites on coordination number: the interactions of a cyclic Schiff base with copper ions2
Transition-metal complexes of group 12 with 1,1′-bis(phosphanyl)ferrocene ligands2
FeIII in a high-spin state in bis(5-bromosalicylaldehyde 4-ethylthiosemicarbazonato-κ3 O,N 1,S)ferrate(III) ni2
Crystal structure, thermal behaviour and detonation characterization of bis(4,5-diamino-1,2,4-triazol-3-yl)methane monohydrate2
Crystal structures of three β-halolactic acids: hydrogen bonding resulting in differing Z′2
Phase behaviour and crystal structures of 2′,3′-difluorinated p-terphenyl derivatives2
Structural studies of various olmesartan solvates2
A fourfold interpenetrating three-dimensional cadmium(II) coordination polymer: synthesis, crystal structure and physical properties2
Synthesis, structural elucidation, characterization and theoretical DFT study of 1-(o-tolyl)biguanidium chloride2
Synthesis and crystal structures of new chiral 3-amino-2H-azirines and the Pd complex of one of them2
Bending properties in the 4-halobenzonitrile crystals and C–halogen...N[triple-bond]C halogen bonds2
Syntheses, structures and magnetic properties of two CoII/NiII isostructural coordination polymers based on an asymmetric semirigid tricarboxylate ligand2
A two-dimensional organic–inorganic lead iodide perovskite: poly[bis(3-fluorocyclobutylammonium) [di-μ-iodido-diiodidoplumbate(VI)]]2
Synthesis, structure and magnetocaloric properties of a new two-dimensional gadolinium(III) coordination polymer based on azobenzene-2,2′,3,3′-tetracarboxylic acid2
Ψ-Polyhedral symbols for coordination geometries of lead(II) with a stereochemically active lone pair2
Crystal structure and synthesis of the bis(anthracene)dicuprate dianion as the dipotassium salt, [K(tetrahydrofuran)2]2[{Cu(9,10-η2-anthracene)}2], the firs2
Removing the C-terminal protecting group enlarges the crystal size: Z–(Gly–Aib)2–OH·H2O2
Crystal structure and photophysical properties of a novel polyoxomolybdate porphyrin2
Crystal structure and characterization of the sulfamethazine–piperidine salt2
Conformational control through co-operative nonconventional C—H...N hydrogen bonds2
Synthesis of luminescent cocrystals based on fluoranthene and the analysis of weak interactions and photophysical properties2
A twofold interpenetrating two-dimensional zinc(II) coordination polymer: synthesis, crystal structure and physical properties2
Crystallographic characterization of three cathinone hydrochlorides new on the NPS market: 1-(4-methylphenyl)-2-(pyrrolidin-1-yl)hexan-1-one (4-MPHP), 4-methyl-1-phenyl-2-(pyrrolidin-1-yl)pentan-1-one2
Honeycomb molecular network based upon a hydrate of 4,6-dichlororesorcinol and the photoproduct rtct-tetrakis(pyridin-4-yl)cyclobutane2
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