New Journal of Chemistry · 2022 · 18 citations · 77 references
Natural SciencesChemistryMaterials ScienceCrystal StructureInorganic ChemistrySpectroscopyChemical BondingCoordination ChemistryCrystal ChemistryInorganic SpectroscopyMetal-ligand BondingTransition Metal ComplexesChalcogenide Structure ChemistryCharge Transfer ComplexationCharge-transfer ComplexesElectronic Spectra Of Transition Metal ComplexesElectronic Structure Of Metal ComplexesMetal-ligand Bonding AnalysisSpectroscopic Characterization Of Metal-ligand BondsSpectroscopy Of Transition Metal Complexes
With halides X − (X = Cl, Br, I) 5,6-dicyano-[1,2,5]selenadiazolo[3,4- b ]pyrazine 1 forms chalcogen-bonded complexes [1–X] − structurally defined by XRD. UV/Vis spectra of [1–X] − feature red-shifted charge-transfer bands in the Vis part.
77
A short history of<i>SHELX</i>
George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 87.4K citations · Full text
VMD: Visual molecular dynamics
William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations
Multiwfn: A multifunctional wavefunction analyzer
Tian Lu, Feiwu Chen · Journal of Computational Chemistry · 2011 · 43K citations