Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Mariana Sladkovicova"'
Publikováno v:
Journal of Molecular Structure. 874:108-120
We report an inelastic neutron scattering (INS) study of a monosaccharide, 1,6-anhydro-β- d -glucopyranose, C 6 O 5 H 10 (levoglucosan). The assignment of the experimental vibrational spectrum measured in the range 30–4000 cm −1 on TOSCA spectro
Publikováno v:
Chemical Physics. 340:245-259
We report an inelastic neutron scattering (INS) study of 2-amino-3-hydroxymethyl-1,3-propane diol (TRIS). The assignment of the experimental vibrational spectra measured using several incident neutrons’ energies on HRMECS spectrometer has been made
Publikováno v:
Zeitschrift für Kristallographie. 222:555-565
Geometry of hydrogen bonds in 2-amino-3-hydroxymethyl-1,3-propane diol (TRIS) was accurately determined by single crystal TOF neutron diffraction at 30 K, 100 K and 170 K. The structure of TRIS can be formally described as a structure formed by layer
Publikováno v:
Open Chemistry. 5:55-70
Geometries of 27 generated conformers of levoglucosan were optimized in vacuo at DFT level of theory combining several functionals with high quality basis sets. For the sake of comparison a reference molecular and crystal geometry obtained from 30 K
Autor:
Juraj Kronek, Jozef Luston, Vratislav Langer, Mariana Sladkovicova, Miroslav Koóš, Dalma Gyepesová
Publikováno v:
Acta Crystallographica Section C Crystal Structure Communications. 61:o602-o606
Crystal structures are reported for three isomeric compounds, namely 2-(2-hydroxyphenyl)-2-oxazoline, (I), 2-(3-hydroxyphenyl)-2-oxazoline, (II), and 2-(4-hydroxyphenyl)-2-oxazoline, (III), all C9H9NO2 [systematic names: 2-(4,5-dihydro-1,3-oxazol-2-y
Publikováno v:
Acta crystallographica. Section B, Structural science. 62(Pt 5)
The geometry of hydrogen bonds in 1,6-anhydro-β-D-glucopyranose (levoglucosan) is accurately determined by refinement of time-of-flight neutron single-crystal diffraction data. Molecules of levoglucosan are held together by a hydrogen-bond array for