Modification of the reactivity of polyhydrides with Lewis acids. Synthesis and reactivity of {IrH5[P(iso-C3H7)3]2}2Cu(CF3SO3). X-ray crystal structure of {IrH2(MeCN)2[P(iso-C3H7)3]2}(BF4)

1990 ◽  
Vol 29 (24) ◽  
pp. 5000-5002 ◽  
Author(s):  
X. D. He ◽  
J. Fernandez-Baeza ◽  
B. Chaudret ◽  
K. Folting ◽  
K. G. Caulton
Keyword(s):  
Crystal Structure ◽  
Lewis Acids ◽  
X Ray

Singly Charged λ6Si-Silicate Anions with an SiF5C Skeleton: Syntheses and Crystal Structure Analyses of the Ionic Hexacoordinate Silicon Compounds [Me3NH][F5SiCH2NMe2H]·H2O and [Me3NH][F5SiCH2NMe2H]·H2O

2000 ◽  
Vol 55 (1) ◽  
pp. 60-64
Author(s):  
Melanie Pülm ◽  
Joachim Becht ◽  
Reinhold Tacke
Keyword(s):  
Crystal Structure ◽  
Lewis Acids ◽  
Molar Ratio ◽  
X Ray Diffraction ◽  
Coordination Polyhedra ◽  
Silicon Compounds ◽  
X Ray ◽  
Distorted Octahedra ◽  
Singly Charged ◽  
Crystalline Hydrates

The zwitterionic λ5Si-tetrafluorosilicates F4SiCH2NMe2H (1) and F4SiCH2NMe3 (2) behave as Lewis acids and react with [Me3NH]F (molar ratio 1:1) in aqueous solution to yield the ionic λ6Si-pentafluorosilicates [Me3NH][F5SiCH2NMe2H] (3) and [Me3NH][F5SiCH2NMe3] (4), respectively. These hexacoordinate silicon compounds contain singly charged λ6Si-silicate anions ([F5SiCH2NMe2H]- , [F5SiCH2NMe3]- ) with an SiF5C skeleton. Compounds 3 and 4 were isolated as the crystalline hydrates 3·H2O (yield 80%) and 4·H2O (yield 82%) which were structurally characterized by single-crystal X-ray diffraction. The Si-coordination polyhedra in the crystals of 3·H2O and 4·H2O are slightly distorted octahedra

scholarly journals Synthese und Reaktionen von 1,2,4,5-Tetramethylimidazol; die Kristallstruktur von Pentamethylimidazolium-iodid / Synthesis and Reactions of 1,2,4,5-Tetramethylimidazole; the Crystal Structure of Pentamethylimidazolium Iodide

1991 ◽  
Vol 46 (12) ◽  
pp. 1706-1712 ◽  
Author(s):  
Norbert Kuhn ◽  
Gerald Henkel ◽  
Jörg Kreutzberg
Keyword(s):  
Crystal Structure ◽  
Solid State ◽  
Methyl Iodide ◽  
Lewis Acids ◽  
Liquid Ammonia ◽  
X Ray ◽  
Ionic Nature ◽  
Subsequent Addition

1,2,4,5-Tetramethylimidazole (3) is obtained by metalation of 2,4,5-trimethylimidazole (2) with sodium in liquid ammonia and subsequent addition of methyl iodide. 3 reacts with Lewis acids to form the compounds Me4C3N2 · BH3 (8) and Me4C3N2 · E+ (4, 5, 7, 10; E = Me, H, SiMe3, C(O)Me). The X-ray structure reveals the ionic nature of pentamethylimidazolium iodide (4) in the solid state.

(3-Iminio-1-propenyl)oxy-borates: New Acyclic Betaines from Enaminocarbonyl Compounds and Boron Trifluoride or Triphenylboron – Synthesis, Crystal Structure Analysis, and Quantum Chemical Calculations

2003 ◽  
Vol 58 (2-3) ◽  
pp. 217-225 ◽  
Author(s):  
Joachim Nikolai ◽  
Gerhard Taubmann ◽  
Gerhard Maas
Keyword(s):  
Crystal Structure ◽  
Gas Phase ◽  
Structure Analysis ◽  
Lewis Acids ◽  
Boron Trifluoride ◽  
Natural Bond Orbital ◽  
Nbo Analysis ◽  
Crystal Structure Analysis ◽  
Dft Methods ◽  
X Ray

Adducts of various acyclic enaminoketones and enaminoaldehydes with the Lewis acids boron trifluoride and triphenylboron were prepared. The adducts were characterized by NMR (1H, 13C, 11B) and IR spectroscopy, FAB-MS, and X-ray crystal structure analysis of the adducts of (E)-3- diethylamino-3-phenyl-2-propenal with BF3 (4a) and BPh3 (5a), respectively. The adduct formation occurs at the oxygen atom of the enaminocarbonyl compound and gives rise to a betainic structure with expressed equalization of the bond orders in the enaminocarbonyl moiety. The gas-phase structures of complexes 4a and 5a and of the corresponding free enaminoaldehyde were determined computationally by RHF and DFT methods, and a Natural Bond Orbital (NBO) analysis was undertaken.

A study on α-RuCl3 crystal structure by scanning tunneling microscopy

1989 ◽  
Vol 47 ◽  
pp. 30-31
Author(s):  
H.-J. Cantow ◽  
H. Hillebrecht ◽  
S. Magonov ◽  
H. W. Rotter ◽  
G. Thiele
Keyword(s):  
Crystal Structure ◽  
Density Distribution ◽  
Scanning Tunneling Microscopy ◽  
Electron Density ◽  
Structure Determination ◽  
Electron Density Distribution ◽  
Scanning Tunneling ◽  
Monoclinic Space Group ◽  
Tunneling Microscopy ◽  
X Ray

From X-ray analysis, the conclusions are drawn from averaged molecular informations. Thus, limitations are caused when analyzing systems whose symmetry is reduced due to interatomic interactions. In contrast, scanning tunneling microscopy (STM) directly images atomic scale surface electron density distribution, with a resolution up to fractions of Angstrom units. The crucial point is the correlation between the electron density distribution and the localization of individual atoms, which is reasonable in many cases. Thus, the use of STM images for crystal structure determination may be permitted. We tried to apply RuCl3 - a layered material with semiconductive properties - for such STM studies. From the X-ray analysis it has been assumed that α-form of this compound crystallizes in the monoclinic space group C2/m (AICI3 type). The chlorine atoms form an almost undistorted cubic closed package while Ru occupies 2/3 of the octahedral holes in every second layer building up a plane hexagon net (graphite net). Idealizing the arrangement of the chlorines a hexagonal symmetry would be expected. X-ray structure determination of isotypic compounds e.g. IrBr3 leads only to averaged positions of the metal atoms as there exist extended stacking faults of the metal layers.

X-ray Crystal Structure of ?9-THC-tosylate

Planta Medica ◽  
2008 ◽  
Vol 74 (03) ◽  
Author(s):  
W Gul ◽  
P Carvalho ◽  
D Slade ◽  
M Avery ◽  
JR Duchek ◽  
...  
Keyword(s):  
Crystal Structure ◽  
X Ray

Crystal structure of an inclusion complex between chiral monoaza-15-crown-5 and S(–)-1-phenyl-ethyl ammonium percholorate

2003 ◽  
Vol 218 (5) ◽  
Author(s):  
Süheyla Özbey ◽  
F. B. Kaynak ◽  
M. Toğrul ◽  
N. Demirel ◽  
H. Hoşgören
Keyword(s):  
Crystal Structure ◽  
Inclusion Complex ◽  
Single Crystal ◽  
X Ray Diffraction ◽  
Space Group ◽  
X Ray ◽  
New Type

AbstractA new type of inclusion complex, S(–)-1 phenyl ethyl ammonium percholorate complex of R-(–)-2-ethyl - N - benzyl - 4, 7, 10, 13 - tetraoxa -1- azacyclopentadecane, has been prepared and studied by NMR, IR and single crystal X-ray diffraction techniques. The compound crystallizes in space group

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