Thio-hydroxoanionen des Germaniums: Darstellung, Struktur und Eigenschaften von Na2GeS2(OH)2 · 5 H2O / Thio-hydroxo Anions of Germanium: Preparation, Structure and Properties of Na2GeS2(OH)2 · 5 H2O

1981 ◽  
Vol 36 (11) ◽  
pp. 1400-1406 ◽  
Author(s):  
Bernt Krebs ◽  
Hans-Joachim Wallstab
Keyword(s):  
Hydrogen Bond ◽  
Aqueous Solutions ◽  
Vibrational Spectra ◽  
Sodium Sulfide ◽  
Structure And Properties ◽  
Orthorhombic Space Group ◽  
X Ray ◽  
Hydrogen Bond System ◽  
Bond System ◽  
Stretching Vibrations

Abstract Pure thio-hydroxo-germanates can be prepared from aqueous solutions by reactions of stoichiometric amounts of either sodium sulfide and GeO2, or NaOH and GeS2. The preparation of colourless crystalline Na2GeS2(OH)2 · 5 H2O is reported. The compound is characterized by a single-crystal X-ray structure analysis. It is orthorhombic, space group Pbcn, with a = 10.752(2), b= 13.787(2), c = 14.150(2) Å. The structure contains novel monomeric GeS2(OH)22- anions with Ge-S bond distances of 2.150(1) and 2.145(1) Å and with Ge-O lengths of 1.809(3) and 1.815(3) Å. An extensive S ··· HO-and O -HO-hydrogen bond system connects the anions with the octahedrally coordinated Na+ ions. The vibrational spectra are reported. The symmetric GeS2 andGeO2 stretching vibrations in the anion are observed at 415 and 618 cm-1.

Solvatisierte HalogenochaLkogen(IV)säuren, I Darstellung und Struktur des Hexabromoselen(IV)säure-Hydrats (H5O2)2SeBr6 · 4H2O / Solvated Halogeno-Chalcogen(IV) Acids, I Preparation and Structure of the Hexabromoselenium(IV) Acid Hydrate (H5O2)2SeBr6 · 4H2O

1979 ◽  
Vol 34 (12) ◽  
pp. 1666-1670 ◽  
Author(s):  
Bernt Krebs ◽  
Michael Hein
Keyword(s):  
Hydrogen Bond ◽  
Single Crystal ◽  
Low Temperatures ◽  
Stoichiometric Composition ◽  
Crystalline Compound ◽  
X Ray ◽  
Hydronium Ions ◽  
Hydrogen Bond System ◽  
Bond System ◽  
Acid Hydrate

Hexabromoselenium(IV) acid with the stoichiometric composition H2SeBr6 · 8 H2O is prepared from solutions of SeBr4 in concentrated aqueous HBr. If separated from the solution, the crystalline compound is stable only at low temperatures.A single crystal X-ray structure analysis at -100 °C (monoclinic, C2/m, a = 1039.4(5), b = 1028.8(4), c = 836.6(3) pm, β = 104.11(4)°) shows the acid to contain, besides regular octahedral SeBr62- ions (Se-Br: 255.3(2)-257.9(2) pm), H5O2+ hydronium ions (O···O: 255(2) pm). The remaining H2O molecules are involved in a hydrogen bond system with O···O: 264(2)-275(2) pm and O···Br: 342(1), 351(1) pm. The formula has to be written as (H5O2)2SeBr6 · 4 H2O.

Synthese, Struktur und Eigenschaften der Hexabromotellur(IV)- und Tridekabromotritellur(IV)säure-Hydrate. Kristallstrukturen der Oxonium-Salze [H9O4]2[TeBr6] und [H9O4][Te3Br13] / Synthesis, Structure and Properties of Hexabromotellurous and Tridecabromotritellurous Acid Hydrates. Crystal Structures of the Oxonium Salts [H9O4]2[TeBr6] and [H9O4][Te3Br13]

1991 ◽  
Vol 46 (7) ◽  
pp. 919-930 ◽  
Author(s):  
Bernt Krebs ◽  
Stefan Bonmann ◽  
Klemens Erpenstein
Keyword(s):  
Concentration Ratio ◽  
Stoichiometric Composition ◽  
Structural Formula ◽  
Structure And Properties ◽  
Space Group ◽  
X Ray ◽  
Edge Sharing Octahedra ◽  
Hydrogen Bond System ◽  
Bond System ◽  
The Mean

From solutions of TeBr4 in concentrated aqueous HBr red needles of the crystalline hexabromotellurous acid with the stoichiometric composition H2TeBr6 · 8H2O (1) were isolated (space group P21/n, a = 7.662(5), b = 9.796(6), c = 11.987(8) Å, β = 91.35(4)° at 259 Κ). If the HBr:TeBr4 concentration ratio in the system TeBr4/HBr/H2O was kept low, a novel acid with formal composition HTe3Br13 ·4 H2O (2) could be prepared (space group Cm, a = 13.501(5), b = 15.453(6), c = 9.153(3) Å, β = 138.11(2)° at 140 Κ). The X-ray structural analysis of 1 shows the acid to contain, besides regular octahedral [TeBr6]2- ions (Te-Br: 2.671(4)-2.716(4) Å), [Η9Ο4]+ hydroxonium ions (O ··· O: 2.48(3)-2.62(3) Å). The [H9O4]+ units are linked through a hydrogen bond system (O ··· O: 2.80(3)-2.97(4) Å) to form a three-dimen-sional network. The formula has to be written as [H9O4]2[TeBr6]. 2 is the first acid in this class with a trinuclear anion. Its structural formula is [H9O4][Te3Br13]. As a fragment of the Te4Br,6 cube the anion consists of three edge-sharing octahedra with a central triply bridging Br. The mean bond distances are 2.515 Å for terminal Te-Br, 2.944 Å for Te-μ2Br and 3.077 Å for Te—μ3Br. The Ο···Ο distances in the isolated [H9O4]+ hydroxonium ions are 2.45(3)-2.57(2) A. Raman spectra of both acids are reported.

Structure refinement, hydrogen-bond system and vibrational spectroscopy of hohmannite, Fe3+2[O(SO4)2]·8H2O

2015 ◽  
Vol 79 (1) ◽  
pp. 11-24 ◽  
Author(s):  
G. Ventruti ◽  
G. Della Ventura ◽  
R. Orlando ◽  
F. Scordari
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Vibrational Spectroscopy ◽  
Structural Model ◽  
Structure Refinement ◽  
X Ray Diffraction ◽  
X Ray ◽  
Hydrogen Bond System ◽  
Bond System ◽  
First Time

AbstractThe crystal structure of hohmannite, Fe3+2[O(SO4)2]·8H2O, was studied by means of single-crystal X-ray diffraction (XRD) and vibrational spectroscopy. The previous structural model was confirmed, though new diffraction data allowed the hydrogen-bond system to be described in greater and more accurate detail.Ab initiocalculations were performed in order to determine accurate H positions and to support the experimental model obtained from XRD data. Infrared and Raman spectra are presented for the first time for this compound and comments are made on the basis of the crystal structure and the known literature for sulfate minerals.

Pyridine 1:1 adducts of urea (Z′ = 1) and thiourea (Z′ = 8)

2018 ◽  
Vol 74 (4) ◽  
pp. 406-410 ◽  
Author(s):  
Mark Strey ◽  
Peter G. Jones
Keyword(s):  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Layer Structure ◽  
Urea Adduct ◽  
Standard Type ◽  
Space Group ◽  
Hydrogen Bond System ◽  
Bond System ◽  
Bifurcated Hydrogen Bond ◽  
Urea Adducts

During our studies of urea and thiourea adducts, we noticed that no adducts with unsubstituted pyridine had been structurally investigated. The 1:1 adduct of pyridine and urea, C5H5N·CH4N2O, crystallizes in the P21/c space group with Z = 4. The structure is of a standard type for urea adducts, whereby the urea molecules form a ribbon, parallel to the a axis, consisting of linked R 2 2(8) rings, and the pyridine molecules are attached to the periphery of the ribbon by bifurcated (N—H...)2N hydrogen bonds. The 1:1 adduct of pyridine and thiourea, C5H5N·CH4N2S, crystallizes in the P21/n space group, with Z = 32 (Z′ = 8). The structure displays similar ribbons to those of the urea adduct. There are two independent ribbons parallel to the b axis at z ≃ 0 and 1 \over 2, and three at z ≃ 1 \over 4 and 3 \over 4; the latter are crosslinked to form a layer structure by additional long N—H...S interactions, which each formally replace one branch of a bifurcated hydrogen-bond system.

X-ray Absorption Spectroscopy Study of the Hydrogen Bond Network in the Bulk Water of Aqueous Solutions

2005 ◽  
Vol 109 (27) ◽  
pp. 5995-6002 ◽  
Author(s):  
Lars-Åke Näslund ◽  
David C. Edwards ◽  
Philippe Wernet ◽  
Uwe Bergmann ◽  
Hirohito Ogasawara ◽  
...  
Keyword(s):  
Hydrogen Bond ◽  
Aqueous Solutions ◽  
Absorption Spectroscopy ◽  
Bulk Water ◽  
Hydrogen Bond Network ◽  
Spectroscopy Study ◽  
X Ray ◽  
Bond Network ◽  
X Ray Absorption

Hydration in aqueous osmolyte solutions: the case of TMAO and urea

2020 ◽  
Vol 22 (20) ◽  
pp. 11614-11624 ◽  
Author(s):  
Christoph J. Sahle ◽  
Martin A. Schroer ◽  
Johannes Niskanen ◽  
Mirko Elbers ◽  
Cy M. Jeffries ◽  
...  
Keyword(s):  
Hydrogen Bond ◽  
Raman Scattering ◽  
Aqueous Solutions ◽  
First Principles ◽  
Raman Scattering Spectroscopy ◽  
X Ray ◽  
Bond Topology

X-ray Raman scattering spectroscopy and first principles simulations reveal details of the hydration and hydrogen-bond topology of trimethylamine N-oxide (TMAO) and urea in aqueous solutions.

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