Ján Titiš
YOU?
Author Swipe
View article: CCDC 2481103: Experimental Crystal Structure Determination
CCDC 2481103: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2481102: Experimental Crystal Structure Determination
CCDC 2481102: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: ESR and Mössbauer Spectroscopy of Iron(III) Spin Crossover Complexes Based on Pentadentate Schiff Base Ligands with Pseudohalide Coligands
ESR and Mössbauer Spectroscopy of Iron(III) Spin Crossover Complexes Based on Pentadentate Schiff Base Ligands with Pseudohalide Coligands Open
Two iron(III) spin crossover complexes [Fe(5Cl-L)(NCS)] (1) and [Fe(5Cl-L)(NCSe)] (2) were synthesized with the pentadentate Schiff base ligand 5Cl-L and thiocyanato and selenocyanato as coligands. 5Cl-L, as an asymmetric {N3O2} donor Schi…
View article: Cu‐Ln (Ln = Gd, Eu, Sm) Dinuclear Complexes Based on Schiff Base <i>o‐van‐en</i> Ligand: Syntheses, Crystal Structures, and Magnetic Properties
Cu‐Ln (Ln = Gd, Eu, Sm) Dinuclear Complexes Based on Schiff Base <i>o‐van‐en</i> Ligand: Syntheses, Crystal Structures, and Magnetic Properties Open
Three new dinuclear complexes [CuCl( o‐van‐en )Ln(H 2 O) 3 Cl]Cl·C 2 H 6 O (Ln = Sm ( 1 ), Eu ( 2 ), Gd ( 3 ); H 2 ( o‐van‐en ) is the Schiff base formed by 2/1 condensation of o‐vanillin and ethylenediamine) were prepared in a single crys…
View article: Two Ni/Ce complexes based on bicompartmental ligands with field supported slow magnetic relaxation
Two Ni/Ce complexes based on bicompartmental ligands with field supported slow magnetic relaxation Open
Dinuclear Ni( ii )/Ce( iii ) complexes [Ni( o-van-dap )Ce(H 2 O)(NO 3 ) 3 ] (1) and [Ni(H 2 O) 2 ( o-van-dmdap )Ce(NO 3 ) 3 ] (2): examples of tuning magnetic properties via a small structural change within the ligands used.
View article: CCDC 2181810: Experimental Crystal Structure Determination
CCDC 2181810: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Magnetostructural D-Correlations and Their Impact on Single-Molecule Magnetism
Magnetostructural D-Correlations and Their Impact on Single-Molecule Magnetism Open
Functional dependence of the axial zero-field splitting parameter D with respect to a properly chosen geometrical parameter (Dstr) in metal complexes is termed the magnetostructural D-correlation. In mononuclear hexacoordinate Ni(II) compl…
View article: Spin Symmetry in Polynuclear Exchange-Coupled Clusters
Spin Symmetry in Polynuclear Exchange-Coupled Clusters Open
The involvement of spin symmetry in the evaluation of zero-field energy levels in polynuclear transition metal and lanthanide complexes facilitates the division of the large-scale Hamiltonian matrix referring to isotropic exchange. This me…
View article: Magnetostructural D‐Correlations and Their Impact to Single‐Molecule Magnetism
Magnetostructural D‐Correlations and Their Impact to Single‐Molecule Magnetism Open
Functional dependence of the axial zero-field splitting parameter D with respect to a properly chosen geometrical parameter (Dstr) in metal complexes is termed the Magnetostructural D-Correlation. In mononuclear hexacoordinate Ni(II) compl…
View article: CCDC 2236260: Experimental Crystal Structure Determination
CCDC 2236260: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2223471: Experimental Crystal Structure Determination
CCDC 2223471: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2223472: Experimental Crystal Structure Determination
CCDC 2223472: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Zero-Field Splitting in Hexacoordinate Co(II) Complexes
Zero-Field Splitting in Hexacoordinate Co(II) Complexes Open
A collection of 24 hexacoordinate Co(II) complexes was investigated by ab initio CASSCF + NEVPT2 + SOC calculations. In addition to the energies of spin–orbit multiplets (Kramers doublets, KD) their composition of the spins is also analyze…
View article: CCDC 2167775: Experimental Crystal Structure Determination
CCDC 2167775: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2167772: Experimental Crystal Structure Determination
CCDC 2167772: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 1992057: Experimental Crystal Structure Determination
CCDC 1992057: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 1992055: Experimental Crystal Structure Determination
CCDC 1992055: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2172963: Experimental Crystal Structure Determination
CCDC 2172963: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2172962: Experimental Crystal Structure Determination
CCDC 2172962: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2154593: Experimental Crystal Structure Determination
CCDC 2154593: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2154596: Experimental Crystal Structure Determination
CCDC 2154596: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2154600: Experimental Crystal Structure Determination
CCDC 2154600: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2154595: Experimental Crystal Structure Determination
CCDC 2154595: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2154594: Experimental Crystal Structure Determination
CCDC 2154594: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Energy Levels in Pentacoordinate d5 to d9 Complexes
Energy Levels in Pentacoordinate d5 to d9 Complexes Open
Energy levels of pentacoordinate d5 to d9 complexes were evaluated according to the generalized crystal field theory at three levels of sophistication for two limiting cases of pentacoordination: trigonal bipyramid and tetragonal pyramid. …
View article: CCDC 2168109: Experimental Crystal Structure Determination
CCDC 2168109: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2168110: Experimental Crystal Structure Determination
CCDC 2168110: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Temperature-dependent dimerization of TCNQ anion-radical in [Ni(bpy)3]2(TCNQ–TCNQ)(TCNQ)2·6H2O: Single-crystal structure, magnetic and quantum chemical study
Temperature-dependent dimerization of TCNQ anion-radical in [Ni(bpy)3]2(TCNQ–TCNQ)(TCNQ)2·6H2O: Single-crystal structure, magnetic and quantum chemical study Open
The crystal structure of Ni(bpy)(3)](2)(TCNQ-TCNQ)(TCNQ)(2)center dot 6H(2)O (1) was studied by X-ray single-crystal structure analysis at 145 K and 100 K. The crystal structures of 1 at these two temperatures are essentially the same as t…