0000000000264390

AUTHOR

Kirsi Salorinne

showing 61 related works from this author

Hydrophobic pocket targeting probes for enteroviruses

2015

Visualization and tracking of viruses without compromising their functionality is crucial in order to understand virus targeting to cells and tissues, and to understand the subsequent subcellular steps leading to virus uncoating and replication. Enteroviruses are important human pathogens causing a vast number of acute infections, and are also suggested to contribute to the development of chronic diseases like type I diabetes. Here, we demonstrate a novel method to target site-specifically the hydrophobic pocket of enteroviruses. A probe, a derivative of Pleconaril, was developed and conjugated to various labels that enabled the visualization of enteroviruses under light and electron micros…

EchovirusEndosomevirusesCoxsackievirus InfectionsBiologyCoxsackievirusmedicine.disease_causeenterovirusesVirusCell Line TumormedicineHumansGeneral Materials Sciencemolecular probesta116OxazolesFluorescent DyesInfectivityOxadiazolesVirus Uncoatingta1182trackingbiology.organism_classificationMolecular biologyEnterovirus B HumanCapsidhydrophobic pocketCytoplasmBiophysicsGoldHydrophobic and Hydrophilic InteractionsNanoscale
researchProduct

Synthesis and structure of mono-bridged resorcinarene host: a ditopic receptor for ammonium guests.

2009

The synthesis and structural properties of tetramethoxy resorcinarene mono-crown-5 (1) are described. The binding characteristics of 1 toward acetylcholine and tetramethylammonium salts were investigated by 1H NMR titration. It was observed that the cavity of 1 provides a better fit to acetylcholine compared to the smaller tetramethylammonium cation, as acetylcholine is able to interact with both the crown ether moiety and the free hydroxyl groups of receptor 1 simultaneously.

Models MolecularMagnetic Resonance SpectroscopyStereochemistryPhenylalanineMolecular ConformationBiochemistrychemistry.chemical_compoundPolymer chemistrymedicineHydroxidesMoietyPhysical and Theoretical ChemistryCrown etherchemistry.chemical_classificationTetramethylammoniumBinding SitesOrganic ChemistryNuclear magnetic resonance spectroscopyResorcinareneCrown CompoundsQuaternary Ammonium CompoundschemistryProton NMRTitrationCalixarenesAcetylcholinemedicine.drugOrganicbiomolecular chemistry
researchProduct

The Structural Diversity of Benzofuran Resorcinarene Leads to Enhanced Fluorescence

2014

An unexpected and previously unknown resorcinarene mono-crown with a fused benzofuran moiety in its macrocyclic core was obtained as a byproduct from a bridging reaction of tetramethoxy resorcinarene with tetraethylene glycol ditosylate. The formation of the fused benzofuran moiety in the resorcinarene macrocycle resulted in a unique rigid and puckered boat conformation, as shown by XRD studies in the solid state. Modification of the macrocycle was also observed to affect the photophysical properties in solution by enhancing the fluorescence brightness compared with a conventional resorcinarene macrocycle. The fluorescent properties enabled unique detection of structural features, that is, …

calixarenesStereochemistryPhenylalanineCyclohexane conformationMolecular ConformationSupramolecular chemistryChemistry Techniques SyntheticConjugated systemCrystallography X-RayBiochemistrysupramolecular chemistryStructure-Activity Relationshipchemistry.chemical_compoundCalixarenePolymer chemistrysupramolekulaarinen kemiaresorcinarenesMoietyBenzofuranX-ray diffractta116BenzofuransMolecular StructureOrganic Chemistryfluoresenssita1182benzofuranGeneral ChemistryResorcinareneFluorescenceX-ray diffractionSpectrometry FluorescencechemistryfluorescenceChemistry - An Asian Journal
researchProduct

Photodynamics of a Molecular Water-Soluble Nanocluster Identified as Au130(pMBA)50

2015

Photodynamics of a highly monodisperse sample of a water-soluble gold nanocluster tentatively identified as Au130(pMBA)50 (pMBA = p-mercaptobenzoic acid) was studied by mid-IR transient absorption spectroscopy with visible excitation. The observed long-lived excited states (>1 ns) indicate a molecular behavior of the cluster. By combining the transient absorption data with DFT calculation results the observed relaxation dynamics could be fully explained by identifying several relaxation processes involving singlet and triplet manifolds. The results indicate that the cluster may have interesting transient magnetic properties due to a long-lived triplet population.

education.field_of_studyta114ChemistryPopulationRelaxation (NMR)Analytical chemistrySurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsGeneral EnergyChemical physicsExcited stateUltrafast laser spectroscopyCluster (physics)mid-IR transient absorption spectroscopySinglet statePhysical and Theoretical ChemistrySpectroscopyeducationta116gold nanoclustersExcitationJournal of Physical Chemistry C
researchProduct

Molecule-like photodynamics of Au102(pMBA)44 nanocluster.

2015

Photophysical properties of a water-soluble cluster Au102(pMBA)44 (pMBA = para-mercaptobenzoic acid) are studied by ultrafast time-resolved mid-IR spectroscopy and density functional theory calculations in order to distinguish between molecular and metallic behavior. In the mid-IR transient absorption studies, visible or near-infrared light is used to electronically excite the sample, and the subsequent relaxation is monitored by studying the transient absorption of a vibrational mode in the ligands. Based on these studies, a complete picture of energy relaxation dynamics is obtained: (1) 0.5-1.5 ps electronic relaxation, (2) 6.8 ps vibrational cooling, (3) intersystem crossing from the low…

ta114ChemistryRelaxation (NMR)General EngineeringGeneral Physics and Astronomytransient absorptionInternal conversion (chemistry)PhotochemistryMolecular physicselectronic relaxationvibrational spectroscopyIntersystem crossinggold nanoclusterUltrafast laser spectroscopyGeneral Materials ScienceDensity functional theoryTriplet stateSpectroscopyGround stateta116femtosecondACS nano
researchProduct

Resorcinarene Podand with Amine-Functionalized Side Arms – Synthesis, Structure, and Binding Properties of a Neutral Anion Receptor

2009

The synthesis and structure of a neutral resorcinarene host bearing four amine-functionalized side arms is described. The anion binding properties were investigated in solution by 1H NMR spectroscopic titration and diffusion experiments and in the gas phase by mass spectrometric studies. It was observed that in solution 1:2 (host/guest) complexes were formed between the resorcinarene host and the basic fluoride and acetate anions, whereas in the gas phase 1:1 complexes with other anions (Cl–, HCOO–, NO3–, and BF4–) were detected additionally. (© Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2009)

TetrafluoroborateStereochemistryOrganic ChemistrySupramolecular chemistryResorcinareneChemical synthesisInclusion compoundchemistry.chemical_compoundchemistryPolymer chemistryTitrationAmine gas treatingPhysical and Theoretical ChemistryAnion bindingEuropean Journal of Organic Chemistry
researchProduct

Structural analysis of two foldamer-type oligoamides – the effect of hydrogen bonding on solvate formation, crystal structures and molecular conforma…

2012

Author's Final draft The crystal structures and molecular conformations of two foldamer-type oligoamides were analyzed. One polymorphic form and seven solvates were found for N¹,N³-bis(2-benzamidophenyl)benzene-1,3-dicarboxamide (the benzene variant), and two polymorphic forms and six solvates for N²,N⁶-bis(2-benzamidophenyl)pyridine-2,6-dicarboxamide (the pyridine variant). Three crystal structures of the benzene variant and seven structures of the pyridine variant were solved using single crystal X-ray diffraction. The crystal structures showed that the different modes of intramolecular hydrogen bonding strongly affect the conformation and folding of the molecules, which is most evidently…

kristallografiafoldameeriHydrogen bondStereochemistryFoldamerGeneral ChemistryCrystal structurekidetiedeCondensed Matter PhysicsoligoamideFolding (chemistry)chemistry.chemical_compoundCrystallographychemistryoligoamidifoldamerIntramolecular forcePyridineMoleculeGeneral Materials Scienceta116Single crystalCrystEngComm
researchProduct

Asymmetric Homoaldol Reactions with Cyclohex-2-enylN,N-Diisopropylcarbamate: Kinetic Resolution, Elucidation of the Stereochemical Course and Applica…

2007

Enantio-enriched cyclohex-2-enyl N,N-diisopropylcarbamate (5) is stereospecifically deprotonated by sec-butyllithium/(–)-sparteine (9) to form the configurationally stable lithium complex 7·9. A kinetic resolution of rac-5 by n-butyllithium/(–)-sparteine (9) yielded (R)-5 with up to 99 % ee. Electrophilic substitution with tin electrophiles proceeds in a anti-SE′ fashion as shown by chemical correlations. The synthesized allylstannanes 10 undergo a highly stereospecific TiCl4-mediated homoaldol reaction with various aldehydes, yielding syn-configured homoaldol products 12. These were transferred into all-cis-configured hexahydroisobenzofuran-4(1H)-ones 22 by BF3·OEt2-mediated reactions with…

Electrophilic substitutionStereospecificityDeprotonationChemistryStereochemistryOrganic ChemistryElectrophileEnantioselective synthesischemistry.chemical_elementLithiumPhysical and Theoretical ChemistryTinKinetic resolutionEuropean Journal of Organic Chemistry
researchProduct

Nondestructive Size Determination of Thiol-Stabilized Gold Nanoclusters in Solution by Diffusion Ordered NMR Spectroscopy

2013

Diffusion ordered NMR spectroscopy (DOSY) was used as an analytical tool to estimate the size of thiol-stabilized gold nanoclusters in solution, namely, phenylethanethiol (PET) stabilized Au25(PET)18, Au38(PET)24, and Au144(PET)60. This was achieved by determining the diffusion coefficient and hydrodynamic radius from solution samples that were confirmed to be monodispersed by electrospray ionization mass spectrometry. The average cluster diameters obtained by this technique were estimated to be 1.7, 2.2, and 3.1 nm for the Au25(PET)18, Au38(PET)24, and Au144(PET)60 nanoclusters, respectively, which were shown to agree well with the average diameters of the corresponding single crystal or t…

Models MolecularMagnetic Resonance SpectroscopyHydrodynamic radiusChemistryDiffusionElectrospray ionizationta221Analytical chemistryNanoparticleNuclear magnetic resonance spectroscopyNanostructuresAnalytical ChemistryCharacterization (materials science)NanoclustersDiffusionGoldSulfhydryl CompoundsParticle SizeSingle crystalta116Analytical Chemistry
researchProduct

Conformation and dynamics of the ligand shell of a water-soluble Au102 nanoparticle

2016

Inorganic nanoparticles, stabilized by a passivating layer of organic molecules, form a versatile class of nanostructured materials with potential applications in material chemistry, nanoscale physics, nanomedicine and structural biology. While the structure of the nanoparticle core is often known to atomic precision, gaining precise structural and dynamical information on the organic layer poses a major challenge. Here we report a full assignment of 1H and 13C NMR shifts to all ligands of a water-soluble, atomically precise, 102-atom gold nanoparticle stabilized by 44 para-mercaptobenzoic acid ligands in solution, by using a combination of multidimensional NMR methods, density functional t…

Magnetic Resonance SpectroscopyScienceGeneral Physics and AstronomyNanoparticleMetal NanoparticlesNanotechnologypara-mercaptobenzoic acid02 engineering and technologyMolecular Dynamics Simulation010402 general chemistry01 natural sciencesGeneral Biochemistry Genetics and Molecular BiologyArticleMolecular dynamicsta116Multidisciplinaryta114LigandligandsQGeneral ChemistryNuclear magnetic resonance spectroscopyliganditCarbon-13 NMR021001 nanoscience & nanotechnology0104 chemical sciencesStructural biologygold nanoparticlesNanomedicineDensity functional theoryGold0210 nano-technologyNature Communications
researchProduct

Resorcinarene Bis-Thiacrowns: Prospective Host Molecules for Silver Encapsulation

2012

Mixed-donor atom tetramethoxy resorcinarene bis-thiacrown hosts, in which the crown unit contains both hard oxygen and soft sulfur donor atoms, were synthesized for soft metal cation binding. The binding properties were investigated both in solution and in the solid state by NMR spectroscopy and X-ray crystallography. It was found that the resorcinarene bis-thiacrowns were able to complex silver cations with remarkable affinity forming readily 1:2 host–guest complexes in solution. The solid state structures also revealed that the bis-thiacrowns form silver complexes in an unanticipated endo- and exo-cavity fashion within the same host molecule. Both the solution and solid state studies indi…

Cation bindingChemistryStereochemistryOrganic ChemistryBinding propertiesSupramolecular chemistrychemistry.chemical_elementGeneral ChemistryNuclear magnetic resonance spectroscopyResorcinareneBiochemistrySulfurAtomPolymer chemistryMoleculeta116Chemistry - An Asian Journal
researchProduct

The Missing Member of the Partially O-Alkylated Resorcinarene Family: Synthesis and Conformation of Methyl Tetramethoxy Resorcinarene

2013

An improved Lewis acid catalyzed synthesis method for methyl tetramethoxy resorcinarene is described, which produced the missing lower rim methyl derivative of this partially O-alkylated resorcinarene family. Structural characterization by means of variable temperature NMR experiments and single crystal X-ray diffraction studies furthermore revealed that the resorcinarene core adopts different conformations in the solid state and in solution. peerReviewed

resorcinareneChemistryStereochemistryOrganic ChemistryMethyl derivativeSolid-stateResorcinareneAlkylationtetramethoxy resorcinareneBiochemistryCatalysissupramolekyylikemiasupramolekulaarinen kemiaLewis acids and basesPhysical and Theoretical Chemistryta116Single crystalresorsinareenitetrametoksiresorsinareeni
researchProduct

Solvent driven formation of silver embedded resorcinarene nanorods

2012

Silver complexes of resorcinarene bis-crown-5 were observed to arrange into nanorods of 2.4 nm in diameter. The left- and right-handed isomers of the inherently chiral resorcinarene host are separated into their own entity in the self-assembly process with the periphery of the nanorods consisting of silver cations included in the cavity.

Materials scienceta114Inorganic chemistryGeneral ChemistryResorcinareneCondensed Matter PhysicsSolventMetalvisual_artPolymer chemistryvisual_art.visual_art_mediumGeneral Materials ScienceNanorodSelectivityta116CrystEngComm
researchProduct

Solid state halogen bonded networks vs. dynamic assemblies in solution: explaining N⋯X interactions of multivalent building blocks

2015

Tetrapyridine functionalized resorcinarene macrocycles were used as multivalent building blocks for the construction of halogen bonded networks with aryl halide linkers. In the solid state, resorcinarene macrocycles and aryl halide linker molecules assembled into interpenetrated, multidimensional halogen bonded networks with porous structure caused by the 3D block scaffold of the resorcinarenes. 19F NMR spectroscopy proved halogen bond formation also in solution, as either upfield or downfield shifts were observed depending on the bivalent or monovalent halogen bond binding mode. The binding mode in solution was explained by density functional theory computations. peerReviewed

chemistry.chemical_classificationHalogen bondta114ChemistryStereochemistryAryl halideSolid-stateGeneral ChemistryResorcinareneCondensed Matter PhysicsCrystallographyhalogen bonded networksHalogenMoleculeGeneral Materials ScienceDensity functional theoryta116Linkerresorcinarene macrocyclesaryl halide linkers
researchProduct

Twisting of the resorcinarene core due to solvent effects upon crystallization

2009

The effect of the crystallization conditions on the conformation of the tetramethoxy resorcinarene skeleton was investigated in acetone solutions, to which was added a second component (less favorable solvent or salt) to promote crystallization. The resorcinarene core was found to adopt three different conformations: crown (I), a pinched crown (II) and a twisted pinched crown (III). In addition, the flexibility of the resorcinarene core was compared with a tetramethoxy resorcinarene derivative, resorcinarene bis-crown, which is in a fixed boat conformation.

chemistry.chemical_classificationCyclohexane conformationSalt (chemistry)General ChemistryResorcinareneCondensed Matter Physicslaw.inventionSolventchemistry.chemical_compoundCrystallographychemistrylawAcetoneOrganic chemistryGeneral Materials ScienceSolvent effectsCrystallizationDerivative (chemistry)CrystEngComm
researchProduct

ChemInform Abstract: Calixcrowns : Synthesis and Properties

2009

The synthesis and properties of calix[n]crowns (n = 4–8), calix[n]biscrowns and their related compounds, resorcinarene crowns, have been discussed and reviewed. These macrocycles exhibit remarkable ionophoric properties toward alkali and alkaline earth metal cations, as well as, to tertiary amines. The selectivity and efficiency of calixcrowns in binding cations have been attributed to their structural features, which include substituent effects and size of the crown ether moiety and, conformation of the parent calixarene.

chemistry.chemical_classificationAlkaline earth metalChemistrySubstituentGeneral MedicineResorcinareneAlkali metalstomatognathic diseaseschemistry.chemical_compoundstomatognathic systemCalixarenePolymer chemistryMoietySelectivityCrown etherChemInform
researchProduct

Synthesis and Characterization of theO-Alkylation Products of Resorcinarene

2013

O-Substitution reactions of tetramethoxyresorcinarene with alkyl halides produced a variety of partially O-alkylated resorcinarene derivatives with terminal alkyne functionality. The degree of alkylation was affected by the reactivity of the alkylating halide used. NMR spectroscopy proved to be an ideal tool for analyzing the complex reaction mixtures and the isolated products based on the symmetry and degree of alkylation of the resorcinarene derivatives. Single-crystal X-ray diffraction studies furthermore showed diversity in the self-assembly of the various O-alkylation products that was greatly affected by the degree of alkylation, as well as the nature of the alkyne moiety.

chemistry.chemical_classificationOrganic ChemistrySupramolecular chemistryAlkyneNuclear magnetic resonance spectroscopyAlkylationResorcinarenechemistryMoietyOrganic chemistrylipids (amino acids peptides and proteins)Reactivity (chemistry)Physical and Theoretical ChemistryAlkylEuropean Journal of Organic Chemistry
researchProduct

Development of functionalized SYBR green II related cyanine dyes for viral RNA detection

2020

Abstract Fluorescent probes for sensing nucleic acids have found widespread use in the field of cell and molecular biology. However, probes combined with potential for post-synthetic conjugation, e.g. for intra-endosomal measurements of RNA, are unavailable. Herein we developed cyanine dyes that can be conjugated to viral capsid or other targets. First, we solved the crystal structure of SYBR Green II. The structural elucidation of this commonly used RNA probe provided the basis for synthesizing similar molecules with much desired function for post-synthetic conjugation. To address this need, cyanine dyes were prepared using an alternative synthesis protocol. All studied compounds showed co…

Process Chemistry and TechnologyGeneral Chemical EngineeringIntercalation (chemistry)RNA02 engineering and technologyConjugated systemChromophore010402 general chemistry021001 nanoscience & nanotechnology01 natural sciencesCombinatorial chemistryFluorescence0104 chemical scienceschemistry.chemical_compoundchemistryCapsidNucleic acidCyanine0210 nano-technologyDyes and Pigments
researchProduct

Synthesis and properties of an Au6 cluster supported by a mixed N-heterocyclic carbene–thiolate ligand

2020

The preparation of a novel Au6 cluster bearing a bidentate mixed carbene–thiolate ligand is presented. The length of linker between the central benzimidazole and thiolate has a strong effect on the formation of cluster products, with a C2 chain giving an Au6 cluster, while a C3 chain results in no evidence of cluster formation. Density functional theory analysis predicts a non-metallic cluster with a large HOMO–LUMO (3.2–3.6 eV) and optical gap.

BenzimidazoleDenticity010405 organic chemistryLigandMetals and AlloysGeneral Chemistry010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialschemistry.chemical_compoundCrystallographychemistryChain (algebraic topology)Materials ChemistryCeramics and CompositesCluster (physics)Density functional theoryCarbeneLinkerChemical Communications
researchProduct

Crystal structure of 5-{3-[2,6-dimethyl- 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]propyl}- N-(11-hydroxyundecyl)isoxazole-3-carboxamide hemihydrate

2015

The crystal structure and supra­molecular features of 5-{3-[2,6-dimethyl-4-(5-methyl-1,2,4-oxa­diazol-3-yl)phen­oxy]prop­yl}-N-(11-hy­droxy­undec­yl)isoxazole-3-carboxamide hemihydrate, a derivative of anti­viral ‘WIN compounds’, are reported.

crystal structuremedicine.drug_classOxadiazoleCarboxamideNanotechnologyCrystal structureDihedral angleRing (chemistry)Medicinal chemistryResearch Communicationschemistry.chemical_compoundmedicinePeptide bondGeneral Materials ScienceIsoxazoleta116oxa­diazoleCrystallographyChemistryHydrogen bondWIN derivativeisoxazoleGeneral ChemistryCondensed Matter PhysicsantiviralQD901-999anti­viraloxadiazoleActa Crystallographica Section E : Crystallographic Communications
researchProduct

Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles

2012

A group of seven resorcinarene bis-crown ethers (CNBC5) with two polyether bridges at the upper rim and either propyl, butyl, pentyl, heptyl, nonyl, decyl or undecyl groups at the lower rim were synthesized and their binding properties with Cs+ were investigated by NMR titration. The bis-crowns form 1:2 complexes with Cs+ with binding constants of logK 4–5. Crystal structures of bis-crowns and their Cs+ and K+ complexes were studied and different packing motifs were found depending on the alkyl chain length. Short ethyl, propyl and butyl alkyl chains gave a layer or pillar packing where the polar and non-polar regions cannot be distinguished, whereas longer pentyl and decyl chains formed bi…

Cation bindingkaliumStereochemistryydinmagneettinen resonanssiCyclohexane conformationsolid lipid nanoparticleamphiphileCrystal structureCatalysisCrystalcesiumAmphiphilesupramolekyylikemiaMaterials Chemistrykiinteä lipidipartikkelisupramolekulaarinen kemiaMoleculemacrocyclic compoundta116Alkylkaliksareeniitsejärjestäytyminenchemistry.chemical_classificationresorcinareneChemistryGeneral Chemistrycaesiumself-assemblyResorcinarenekompleksiCrystallographynuclear magnetic resonanceamfifiilimakrosyklinen yhdistecalixarenecomplexröntgenkristallografiaresorsinareeni
researchProduct

Ultrafast electronic relaxation and vibrational cooling dynamics of Au 144(SC2H4Ph)60 nanocluster probed by transient mid-IR spectroscopy

2014

Energy relaxation dynamics of a gold nanocluster with atomically precise composition, Au144(SC2H4Ph)60, is studied by transient mid-IR spectroscopy. The experiment is designed to simultaneously pro...

ta114ChemistryDynamics (mechanics)Analytical chemistryMolecular physicsSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsGeneral EnergyVibrational energy relaxationRelaxation (physics)Transient (oscillation)Physical and Theoretical ChemistrySpectroscopyUltrashort pulseta116The Journal of Physical Chemistry C
researchProduct

Site-specific targeting of enterovirus capsid by functionalized monodisperse gold nanoclusters

2014

Development of precise protocols for accurate site-specific conjugation of monodisperse inorganic nanoparticles to biological material is one of the challenges in contemporary bionanoscience and nanomedicine. We report here a successful site-specific covalent conjugation of functionalized atomically monodisperse gold clusters with 1.5-nm metal cores to viral surfaces. Water-soluble Au102(para-mercaptobenzoic acid)44 clusters, functionalized by maleimide linkers to target cysteines of viral capsid proteins, were synthesized and conjugated to enteroviruses echovirus 1 and coxsackievirus B3. Quantitative analysis of transmission electron microscopy images and the known virus structures showed …

EchovirusMaterials sciencevirusesta221Metal NanoparticlesConjugated systemmedicine.disease_causeVirusCell LineNanoclusterschemistry.chemical_compoundCapsidMicroscopy Electron Transmissionmedicineta116MaleimideEnterovirusMultidisciplinaryta114ta1182CrystallographychemistryCapsidCovalent bondPhysical SciencesBiophysicsNanomedicineGoldProceedings of the National Academy of Sciences
researchProduct

Jahn–Teller effects in Au25(SR)18

2016

The relationship between oxidation state, structure, and magnetism in many molecules is well described by first-order Jahn–Teller distortions. This relationship is not yet well defined for ligated nanoclusters and nanoparticles, especially the nano-technologically relevant gold-thiolate protected metal clusters. Here we interrogate the relationships between structure, magnetism, and oxidation state for the three stable oxidation states, −1, 0 and +1 of the thiolate protected nanocluster Au25(SR)18. We present the single crystal X-ray structures of the previously undetermined charge state Au25(SR)18+1, as well as a higher quality single crystal structure of the neutral compound Au25(SR)180. …

ta114ChemistryMagnetismJahn–Teller effectNanoparticleJahn–Teller distortions02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesNanoclusterslaw.inventionSQUIDCrystallographyOxidation statelawMolecule0210 nano-technologySingle crystalta116gold nanoclustersChemical Science
researchProduct

The Effect of Halogen Bonding on the Packing of Bromine Substituted Pyridine and Benzyl Functionalized Resorcinarene Tetrapodands in the Solid State

2012

The synthesis and characterization of new bromine-substituted pyridine and benzyl functionalized tetramethoxy resorcinarene tetrapodands are described and their solid-state structural properties and interactions were studied by single crystal X-ray crystallography. Three different crystal structures were obtained for the pyridine derivative and one for the benzyl derivative, which revealed that the interactions of the bromine substituent have an explicit effect on the crystal packing of the resorcinarene molecules. One of the structures obtained had very interesting halogen–halogen interactions with the same geometry as is generally found for compounds used in nonlinear optical studies.

Halogen bondSubstituentGeneral ChemistryCrystal structureResorcinareneCondensed Matter Physicschemistry.chemical_compoundchemistryPyridinePolymer chemistryMoleculeOrganic chemistryGeneral Materials ScienceSingle crystalta116Derivative (chemistry)CrystEngComm
researchProduct

Solvation chemistry of water-soluble thiol-protected gold nanocluster Au102 from DOSY NMR spectroscopy and DFT calculations

2014

The hydrodynamic diameter of Aum(pMBA)n [(m, n) = (102, 44) and (144, 60)] clusters in aqueous media was determined via DOSY NMR spectroscopy. The apparent size of the same (n, m) cluster depends on the counter ion of the deprotonated pMBA− ligand as explained by the competing ion-pair strength and hydrogen bonding interactions studied in DFT calculations. The choice of the counter ion affects the surface chemistry and molecular structure at the organic/water interface, which is relevant for biological applications.

chemistry.chemical_classificationDeprotonationchemistryHydrogen bondComputational chemistryLigandSolvationCluster (physics)MoleculeGeneral Materials ScienceNuclear magnetic resonance spectroscopyCounterionNanoscale
researchProduct

Novel Tetramethoxy Resorcinarene Bis-Crown Ethers

2006

The synthesis and characterization of new tetramethoxy resorcinarene bis-crown ethers BC4 and BC5 are described. The complexation properties of the compounds toward alkali metal cations were studied by 1H NMR spectroscopy and X-ray crystallography, which revealed that BC5 can accommodate two cations simultaneously inside the crown pockets formed by the crown ether bridges and the resorcinarene skeleton. [reaction: see text].

chemistry.chemical_classification1h nmr spectroscopyChemistryOrganic ChemistryCrown (botany)Polymer chemistryOrganic chemistryPhysical and Theoretical ChemistryResorcinareneAlkali metalBiochemistryCrown etherOrganic Letters
researchProduct

Characterization and synthesis of O- and N-tosylated N,N-bis(2-aminophenyl)isophthalamide based ligands

2009

Abstract A synthetic strategy for the preparation of O - and N- tosylated N , N -bis(2-aminophenyl)isophthalamide based ligands is described. It was observed that selectivity in O - and N -tosylation could be achieved by performing the reaction at low temperatures in the presence of an appropriate base. The obtained O - and N -tosylated products were characterized by means of NMR and mass spectroscopy, and X-ray crystallography.

Inorganic Chemistrychemistry.chemical_classificationCrystallographyBase (chemistry)ChemistryOrganic ChemistryX-ray crystallographyNuclear magnetic resonance spectroscopySelectivityMass spectrometryMedicinal chemistrySpectroscopyAnalytical ChemistryJournal of Molecular Structure
researchProduct

Polymorphic and solvate structures of ethyl ester and carboxylic acid derivatives of WIN 61893 analogue and their stability in solution

2014

3-Ethyl ester- (1) and 3-carboxylic acid-isoxazole (2) derivatives of an antiviral drug analogue WIN 61893 were synthesized and characterized by X-ray crystallography and NMR spectroscopy. Crystallization experiments afforded two polymorphic structures for the ethyl ester derivative and two solvate structures for the carboxylic acid derivative based on their ability to form intermolecular hydrogen bonding interactions with the solvent molecules. The conformations of the derivatives depended greatly on the orientation of the planar isoxazole and phenyl-oxadiazole ring systems with respect to one another and were found to take up perpendicular, linear or tilted conformations. The carboxylic a…

chemistry.chemical_classificationNitrileStereochemistryHydrogen bondDecarboxylationCarboxylic acidGeneral ChemistryNuclear magnetic resonance spectroscopyCondensed Matter PhysicsRing (chemistry)Solventchemistry.chemical_compoundchemistryGeneral Materials ScienceIsoxazoleta116CrystEngComm
researchProduct

Alkali metal complexation properties of resorcinarene bis-crown ethers: effect of the crown ether functionality and preorganization on complexation

2008

Abstract The synthesis and characterization of tetramethoxy resorcinarene tribenzo-bis-crown ethers, m - and p -TBBC6 , are described. The effect of the added aromatic functionality in the crown ether bridge on the alkali metal complexation properties was investigated and compared to the properties of tetramethoxy resorcinarene bis-crown-5 ( BC5 ) by means of 1 H NMR spectroscopy and X-ray crystallography. It was found that BC5 and m -TBBC6 were capable of binding alkali metal cations (K + , Rb + , and Cs + ), with the highest affinity toward Cs + cation, while no binding was observed in the case of p -TBBC6 , which confirms the significance of the complementarity and preorganization for co…

chemistry.chemical_classificationChemistryOrganic ChemistryDrug DiscoveryPolymer chemistryInorganic chemistryProton NMRNO bindingResorcinareneAlkali metalSpectroscopyBiochemistryCrown etherTetrahedron
researchProduct

4,4-Di-fluoro-2,3;5,6-bis-(tetra-methylene)-4-bora-3a,4a-di-aza-s-indacene (LD540).

2014

The title compound, C18H21BF2N2, is a lipophilic dye based on a BODIPY fluorophore backbone, which was developed for microscopic imaging of lipid droplets; the molecule has a planar BODIPY core [dihedral angle between the pyrrole rings = 2.3 (3)°] and two tetramethylene substituents at the 2,3- and 5,6-positions in a half-chair conformation. One of the tetramethylene substituents is disordered over two two sets of sites with site occupancies of 0.5. In the crystal, pairs of C—H...F interactions link the molecules into inversion dimers. Neighbouring dimers are linked by further C—H...F interactions, forming an infinite array. C—H...π and π–π [centroid–centroid distance = 4.360 (3) Å] interac…

BODIBYDimerDihedral angleBioinformaticsOrganic PapersCrystallcsh:Chemistrychemistry.chemical_compoundBODIPYlipophilic dyesingle-crystal X-ray studyGeneral Materials Scienceta116Pyrrolelipofiilinen väriaineyksikideröntgendiffraktiotutkimusbiologyGeneral ChemistryCondensed Matter Physicsbiology.organism_classificationLD540Crystallographychemistrylcsh:QD1-999Microscopic imagingTetraBODIPYActa crystallographica. Section E, Structure reports online
researchProduct

One-pot synthesis and characterization of subnanometre-size benzotriazolate protected copper clusters

2012

A simple one-pot method for the preparation of subnanometre-size benzotriazolate (BTA) protected copper clusters, Cu(n)BTA(m), is reported. The clusters were analyzed by optical and infrared spectroscopy, mass spectrometry and transmission electron microscopy together with computational methods. We suggest a structural motif where the copper core of the Cu(n)BTA(m) clusters is protected by BTA-Cu(i)-BTA units.

ta114Inorganic chemistryOne-pot synthesischemistry.chemical_elementInfrared spectroscopyTriazolesMass spectrometryCopperCharacterization (materials science)CrystallographychemistryCoordination ComplexesTransmission electron microscopyQuantum TheorySpectrophotometry UltravioletGeneral Materials ScienceStructural motifta116CopperNanoscale
researchProduct

Vibrational Perturbations and Ligand–Layer Coupling in a Single Crystal of Au144(SC2H4Ph)60 Nanocluster

2015

We have determined vibrational signatures and optical gap of the Au144(PET)60 (PET: phenylethylthiol, SC2H4Ph) nanocluster solvated in deuterated dichloromethane (DCM-D2, CD2Cl2) and in a single crystal. For crystals, solid-state (13)C NMR and X-ray diffraction were also measured. A revised value of 2200 cm(-1) (0.27 eV) was obtained for the optical gap in both phases. The vibrational spectra of solvated AU144(PET)60 closely resembles that of neat PET, while the crystalline-state spectrum exhibits significant inhomogeneous spectral broadening, frequency shifts, intensity transfer between vibrational modes, and an increase in the overtone and combination transition intensities. Spectral broa…

ta114ChemistryOvertoneta221Analytical chemistryOvertone bandMolecular physicsHot bandCrystalMolecular vibrationGeneral Materials SciencePhysical and Theoretical ChemistryRotational–vibrational couplingSingle crystalta116Doppler broadeningThe Journal of Physical Chemistry Letters
researchProduct

Exploring the atomic structure of 1.8 nm monolayer-protected gold clusters with aberration-corrected STEM

2017

Abstract Monolayer-protected (MP) Au clusters present attractive quantum systems with a range of potential applications e.g. in catalysis. Knowledge of the atomic structure is needed to obtain a full understanding of their intriguing physical and chemical properties. Here we employed aberration-corrected scanning transmission electron microscopy (ac-STEM), combined with multislice simulations, to make a round-robin investigation of the atomic structure of chemically synthesised clusters with nominal composition Au 144 (SCH 2 CH 2 Ph) 60 provided by two different research groups. The MP Au clusters were “weighed” by the atom counting method, based on their integrated intensities in the high …

Icosahedral symmetrymonolayer-Protected Gold Clusters02 engineering and technology010402 general chemistry01 natural sciencesMolecular physicsatomic structureatom counting methodMonolayerScanning transmission electron microscopyAu144(SR)60ta116InstrumentationQuantumaberration-Corrected STEMRange (particle radiation)ta114Chemistry021001 nanoscience & nanotechnologyDark field microscopyAtomic and Molecular Physics and Optics0104 chemical sciencesElectronic Optical and Magnetic MaterialsAmorphous solidExponentAtomic physics0210 nano-technologyUltramicroscopy
researchProduct

Development of functionalized SYBR green II related cyanine dyes for viral RNA detection

2020

Fluorescent probes for sensing nucleic acids have found widespread use in the field of cell and molecular biology. However, probes combined with potential for post-synthetic conjugation, e.g. for intra-endosomal measurements of RNA, are unavailable. Herein we developed cyanine dyes that can be conjugated to viral capsid or other targets. First, we solved the crystal structure of SYBR Green II. The structural elucidation of this commonly used RNA probe provided the basis for synthesizing similar molecules with much desired function for post-synthetic conjugation. To address this need, cyanine dyes were prepared using an alternative synthesis protocol. All studied compounds showed considerabl…

nucleic acidscyaninesväriaineetviruksetfluorescent probesRNA recognitionfluoresenssisynteettiset väriaineetRNAvirusesnukleiinihapotmerkkiaineethost-guest systems
researchProduct

The Effect of Halogen Bonding on the Packing of Bromine Substituted Pyridine and Benzyl Functionalized Resorcinarene Tetrapodands in the Solid State

2012

The synthesis and characterization of new bromine-substituted pyridine and benzyl functionalized tetramethoxy resorcinarene tetrapodands are described and their solid-state structural properties and interactions were studied by single crystal X-ray crystallography. Three different crystal structures were obtained for the pyridine derivative and one for the benzyl derivative, which revealed that the interactions of the bromine substituent have an explicit effect on the crystal packing of the resorcinarene molecules. One of the structures obtained had very interesting halogen–halogen interactions with the same geometry as is generally found for compounds used in nonlinear optical studies. pee…

resorcinarenesupramolekyylikemiahalogen interactionsupramolekulaarinen kemiahalogeenivuorovaikutusresorsinareeni
researchProduct

Jahn–Teller effects in Au25(SR)18

2016

The relationship between oxidation state, structure, and magnetism in many molecules is well described by first-order Jahn–Teller distortions. This relationship is not yet well defined for ligated nanoclusters and nanoparticles, especially the nano-technologically relevant gold-thiolate protected metal clusters. Here we interrogate the relationships between structure, magnetism, and oxidation state for the three stable oxidation states, 1, 0 and +1 of the thiolate protected nanocluster Au25(SR)18. We present the single crystal X-ray structures of the previously undetermined charge state Au25(SR)18+1, as well as a higher quality single crystal structure of the neutral compound Au25(SR)180 . …

Jahn–Teller distortionsgold nanoclusters
researchProduct

CCDC 919270: Experimental Crystal Structure Determination

2013

Related Article: Tiia-Riikka Tero, Aku Suhonen, Kirsi Salorinne, Hélène Campos-Barbosa, Maija Nissinen|2013|Org.Lett.|15|1096|doi:10.1021/ol400118t

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters6121824-Tetramethoxy-281420-tetramethylpentacyclo[19.3.1.137.1913.11519]octacosa-1(25)3(28)469(27)101215(26)16182123-dodecaene-4101622-tetrol hydrateExperimental 3D Coordinates
researchProduct

CCDC 1044958: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

Space GroupCrystallography6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-3-yl)methoxy)calix(4)arene sesquikis(1245-tetrafluoro-36-diiodobenzene) deuterochloroform solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 999257: Experimental Crystal Structure Determination

2014

Related Article: Kirsi Salorinne, Tanja Lahtinen, Varpu Marjomäki, Hannu Häkkinen|2014|CrystEngComm|16|9001|doi:10.1039/C4CE01152J

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters5-(3-(26-Dimethyl-4-(5-methyl-124-oxadiazol-3-yl)phenoxy)propyl)isoxazole-3-carboxylic acid dimethyl sulfoxide solvateExperimental 3D Coordinates
researchProduct

CCDC 999254: Experimental Crystal Structure Determination

2014

Related Article: Kirsi Salorinne, Tanja Lahtinen, Varpu Marjomäki, Hannu Häkkinen|2014|CrystEngComm|16|9001|doi:10.1039/C4CE01152J

Space GroupCrystallographyCrystal SystemCrystal StructureEthyl 5-(3-(26-dimethyl-4-(5-methyl-124-oxadiazol-3-yl)phenoxy)propyl)isoxazole-3-carboxylateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1482405: Experimental Crystal Structure Determination

2020

Related Article: Ville K. Saarnio, Kirsi Salorinne, Visa P. Ruokolainen, Jesper R. Nilsson, Tiia-Riikka Tero, Sami Oikarinen, L. Marcus Wilhelmsson, Tanja M. Lahtinen, Varpu S. Marjomäki|2020|Dyes Pigm.|177|108282|doi:10.1016/j.dyepig.2020.108282

3-methyl-2-((2-(methylsulfanyl)-1-phenylquinolin-4(1H)-ylidene)methyl)-13-benzoxazol-3-ium chloride methanol solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 943017: Experimental Crystal Structure Determination

2014

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Heli Lehtivuori, Janne A. Ihalainen, Maija Nissinen|2014|Chem.Asian J.|9|1860|doi:10.1002/asia.201402016

Space GroupCrystallographyCrystal System(243740-Triethyl-2203343-tetramethoxy-30-methyl-5811141729-hexaoxaheptacyclo[19.16.3.2^2528^.1^3236^.0^439^.0^1823^.0^2731^]tritetraconta-1318202225273032(41)33353842-tridecaen-35-ol benzofuran resorcinarene mono-crown) ethanol solvate hemihydrateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 943016: Experimental Crystal Structure Determination

2014

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Heli Lehtivuori, Janne A. Ihalainen, Maija Nissinen|2014|Chem.Asian J.|9|1860|doi:10.1002/asia.201402016

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters243740-Triethyl-2203343-tetramethoxy-30-methyl-5811141729-hexaoxaheptacyclo[19.16.3.2^2528^.1^3236^.0^439^.0^1823^.0^2731^]tritetraconta-1318202225273032(41)33353842-tridecaen-35-ol methanol solvate monohydrateExperimental 3D Coordinates
researchProduct

CCDC 943015: Experimental Crystal Structure Determination

2014

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Heli Lehtivuori, Janne A. Ihalainen, Maija Nissinen|2014|Chem.Asian J.|9|1860|doi:10.1002/asia.201402016

Space GroupCrystallographyCrystal SystemCrystal Structure243740-triethyl-2203343-tetramethoxy-30-methyl-5811141729-hexaoxaheptacyclo[19.16.3.2^2528^.1^3236^.0^439^.0^1823^.0^2731^]tritetraconta-1318202225273032(41)33353842-tridecaen-35-ol ethanol solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1055143: Experimental Crystal Structure Determination

2015

Related Article: Marcus A. Tofanelli, Kirsi Salorinne, Thomas W. Ni, Sami Malola, Brian Newell, Billy Phillips, Hannu Häkkinen, Christopher J. Ackerson|2016|Chemical Science|7|1882|doi:10.1039/C5SC02134K

Space GroupCrystallographyCrystal SystemCrystal Structureoctadecakis(mu2-2-Phenylethanethiolato)-pentacosa-gold toluene solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 919269: Experimental Crystal Structure Determination

2013

Related Article: Tiia-Riikka Tero, Aku Suhonen, Kirsi Salorinne, Hélène Campos-Barbosa, Maija Nissinen|2013|Org.Lett.|15|1096|doi:10.1021/ol400118t

Space GroupCrystallographyCrystal System6121824-Tetramethoxy-281420-tetramethyl-4101622-tetrahydroxycalix(4)arene methanol solvate monohydrateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 919268: Experimental Crystal Structure Determination

2013

Related Article: Tiia-Riikka Tero, Aku Suhonen, Kirsi Salorinne, Hélène Campos-Barbosa, Maija Nissinen|2013|Org.Lett.|15|1096|doi:10.1021/ol400118t

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters6121824-Tetramethoxy-281420-tetramethylpentacyclo[19.3.1.137.1913.11519]octacosa-1(25)3(28)469(27)101215(26)16182123-dodecaene-4101622-tetrol hydrateExperimental 3D Coordinates
researchProduct

CCDC 1044955: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

Space GroupCrystallography6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-4-yl)methoxy)calix(4)arene deuterochloroform solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1985367: Experimental Crystal Structure Determination

2020

Related Article: Kirsi Salorinne, Renee W. Y. Man, Paul A. Lummis, Maryam Sabooni Asre Hazer, Sami Malola, Jacky C.-H. Yim, Alex J. Veinot, Wenxia Zhou, Hannu Häkkinen, Masakazu Nambo, Cathleen M. Crudden|2020|Chem.Commun.|56|6102|doi:10.1039/D0CC01482F

Space GroupCrystallographyCrystal SystemCrystal Structure{1-[2-(acetylsulfanyl)ethyl]-3-isopropylbenzimidazol-2-ylidene}-bromo-gold(i)Cell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1482404: Experimental Crystal Structure Determination

2020

Related Article: Ville K. Saarnio, Kirsi Salorinne, Visa P. Ruokolainen, Jesper R. Nilsson, Tiia-Riikka Tero, Sami Oikarinen, L. Marcus Wilhelmsson, Tanja M. Lahtinen, Varpu S. Marjomäki|2020|Dyes Pigm.|177|108282|doi:10.1016/j.dyepig.2020.108282

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2-((2-((2-(dimethylamino)ethyl)sulfanyl)-1-phenylquinolin-4(1H)-ylidene)methyl)-3-methyl-13-benzoxazol-3-ium iodideExperimental 3D Coordinates
researchProduct

CCDC 919271: Experimental Crystal Structure Determination

2013

Related Article: Tiia-Riikka Tero, Aku Suhonen, Kirsi Salorinne, Hélène Campos-Barbosa, Maija Nissinen|2013|Org.Lett.|15|1096|doi:10.1021/ol400118t

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters6121824-Tetramethoxy-281420-tetramethyl-4101622-tetrahydroxycalix(4)arene dihydrateExperimental 3D Coordinates
researchProduct

CCDC 1044957: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

Space GroupCrystallographyCrystal System6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-4-yl)methoxy)calix(4)arene chloroform ethanol solvateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1055144: Experimental Crystal Structure Determination

2015

Related Article: Marcus A. Tofanelli, Kirsi Salorinne, Thomas W. Ni, Sami Malola, Brian Newell, Billy Phillips, Hannu Häkkinen, Christopher J. Ackerson|2016|Chemical Science|7|1882|doi:10.1039/C5SC02134K

Space GroupCrystallographyCrystal SystemCrystal Structureoctadecakis(mu2-2-Phenylethanethiolato)-pentacosa-gold hexafluorophosphateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1985364: Experimental Crystal Structure Determination

2020

Related Article: Kirsi Salorinne, Renee W. Y. Man, Paul A. Lummis, Maryam Sabooni Asre Hazer, Sami Malola, Jacky C.-H. Yim, Alex J. Veinot, Wenxia Zhou, Hannu Häkkinen, Masakazu Nambo, Cathleen M. Crudden|2020|Chem.Commun.|56|6102|doi:10.1039/D0CC01482F

Space GroupCrystallographytetrakis(mu-1-isopropyl-3-(2-thiolatoethyl)benzimidazol-2-ylidene)-hexa-gold bis(hexafluorophosphate) ethanol solvate monohydrateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1044956: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-3-yl)methoxy)calix(4)arene methanol solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1044959: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

Space GroupCrystallography6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-4-yl)methoxy)calix(4)arene bis(1245-tetrafluoro-36-diiodobenzene) chloroform solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1044954: Experimental Crystal Structure Determination

2015

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Sami Malola, Hannu Häkkinen, Maija Nissinen|2015|CrystEngComm|17|8231|doi:10.1039/C5CE01144B

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters6121824-tetramethoxy-281420-tetramethyl-4101622-tetrakis((pyridin-4-yl)methoxy)calix(4)arene acetonitrile chloroform solvateExperimental 3D Coordinates
researchProduct

CCDC 999255: Experimental Crystal Structure Determination

2014

Related Article: Kirsi Salorinne, Tanja Lahtinen, Varpu Marjomäki, Hannu Häkkinen|2014|CrystEngComm|16|9001|doi:10.1039/C4CE01152J

Space GroupCrystallographyCrystal SystemCrystal StructureEthyl 5-(3-(26-dimethyl-4-(5-methyl-124-oxadiazol-3-yl)phenoxy)propyl)isoxazole-3-carboxylateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 943014: Experimental Crystal Structure Determination

2014

Related Article: Tiia-Riikka Tero, Kirsi Salorinne, Heli Lehtivuori, Janne A. Ihalainen, Maija Nissinen|2014|Chem.Asian J.|9|1860|doi:10.1002/asia.201402016

Space GroupCrystallographyCrystal SystemCrystal Structure243740-triethyl-2203343-tetramethoxy-30-methyl-5811141729-hexaoxaheptacyclo[19.16.3.2^2528^.1^3236^.0^439^.0^1823^.0^2731^]tritetraconta-1318202225273032(41)33353842-tridecaen-35-ol acetonitrile solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 999256: Experimental Crystal Structure Determination

2014

Related Article: Kirsi Salorinne, Tanja Lahtinen, Varpu Marjomäki, Hannu Häkkinen|2014|CrystEngComm|16|9001|doi:10.1039/C4CE01152J

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters5-(3-(26-Dimethyl-4-(5-methyl-124-oxadiazol-3-yl)phenoxy)propyl)isoxazole-3-carboxylic acid ethanol solvateExperimental 3D Coordinates
researchProduct