0000000000288047

AUTHOR

Maarten M. J. Smulders

showing 3 related works from this author

Unravelling the fine structure of stacked bipyridine diamine-derived C-3-discotics as determined by X-ray diffraction, quantum-chemical calculations,…

2011

An in depth investigation of the fine structure adopted by the helical stacks of C3-discotics 1 incorporating three 3,3'-diamino-2,2'-bipyridine units is described. In the bulk the molecules display liquid crystalline behaviour in a temperature window of >300 K and an ordered rectangular columnar mesophase (Colro) with an inter-disc distance of 3.4 Å is assigned. X-Ray diffraction on aligned samples has also revealed a helical superstructure in the liquid crystalline state, and a rotation angle of 13–16° between consecutive discs. The proposed superstructure in the bulk phase has been further substantiated by a combination of quantum-chemical calculations and solid-state NMR spectroscopy…

CrystallographyIsodesmic reactionChemistryHydrogen bondIntermolecular forceX-ray crystallographyMesophaseMoleculeGeneral ChemistryNuclear magnetic resonance spectroscopySuperstructure (condensed matter)Chemical Science
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Use of Ambient Ionization High-Resolution Mass Spectrometry for the Kinetic Analysis of Organic Surface Reactions

2016

In contrast to homogeneous systems, studying the kinetics of organic reactions on solid surfaces remains a difficult task due to the limited availability of appropriate analysis techniques that are general, high-throughput, and capable of offering quantitative, structural surface information. Here, we demonstrate how direct analysis in real time mass spectrometry (DART-MS) complies with above considerations and can be used for determining interfacial kinetic parameters. The presented approach is based on the use of a MS tag that - in principle - allows application to other reactions. To show the potential of DART-MS, we selected the widely applied strain-promoted alkyne-azide cycloaddition …

Kinetic analysisKineticsAnalytical chemistry010402 general chemistryKinetic energyMass spectrometry01 natural sciencesReaccions químiquesElectrochemistryLife ScienceGeneral Materials ScienceSpectroscopyAmbient ionizationVLAG010405 organic chemistryChemistryOrganic ChemistrySurfaces and InterfacesCondensed Matter PhysicsDART ion sourceOrganische ChemieCycloaddition0104 chemical sciencesOrganic reactionChemical physicsQuímica orgànicaLangmuir
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Papers accepted for publication in The Analyst

1973

Environmental EngineeringMaterials scienceIndustrial and Manufacturing EngineeringProceedings of the Society for Analytical Chemistry
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