Novel transition metal phospha-alkyne complexes. X-Ray crystal and molecular structure of a side-bonded ButCP complex of zerovalent platinum, Pt(PPh3)2(ButCP)

1981 ◽  
pp. 1141-1143 ◽  
Author(s):  
James C. T. R. Burckett-St. Laurent ◽  
Peter B. Hitchcock ◽  
Harold W. Kroto ◽  
John F. Nixon
Keyword(s):  
Molecular Structure ◽  
Transition Metal ◽  
Crystal And Molecular Structure ◽  
X Ray ◽  
Alkyne Complexes

Gehinderte Ligandbewegungen in Übergangsmetallkomplexen, XXXVII [1]: Photoreaktion von Dekacarbonyldirhenium mit Phenylallen / Hindered Ligand Motions in Transition Metal Complexes, XXXVII [1]: Photoreaction of Decacarbonyldirhenium with Phenylallene

1990 ◽  
Vol 45 (6) ◽  
pp. 793-802 ◽  
Author(s):  
Cornelius G. Kreiter ◽  
Wolfgang Michels ◽  
Reiner Exner
Keyword(s):  
Molecular Structure ◽  
Solid State ◽  
Transition Metal ◽  
Transition Metal Complexes ◽  
Crystal And Molecular Structure ◽  
Dinuclear Complexes ◽  
Rotation Barrier ◽  
Single Bond ◽  
Hindered Rotation ◽  
X Ray

Decacarbonyldirhenium (1) and phenylallene (2) form upon UV irradiation four dinuclear complexes: Decacarbonyl-μ-η1:1-(3,4-diphenyl-1,5-hexadien-2,5-diyl)-dirhenium (3), enneacarbonyl-μ-ηl:3-(3-phenyl-2-propen-1,2-diyl)-dirhenium (4), octacarbonyl-μ-hydrido-μ-η1:2-(3-phenyl-1,2-propadien-l-yl)-dirhenium (5) and octacarbonyl-μ-η2:2-(phenyl-1,2-propadiene)-dirhenium (6). The thermolabile complex 4 looses CO and forms the phenylallene bridged compound 6. Similarly 5 is rearranged to 6 by transfer of the hydrido ligand to the 3-phenyl-1,2-propadien-1-yl bridge. The formation of 3 and 4 can be rationalized via pentacarbonyl-phenylpropenediyl-rhenium radicals which dimerize to give 3 or add pentacarbonylrhenium radicals, loose CO and form 4. The crystal and molecular structure of 3 was determined by X-ray structure analysis. In the solid state the molecule is present in the ± ap conformation. In solution at 233 K the ±ap, +sc, and –sc conformations are equally populated. By a hindered rotation around a CC single bond, the three conformers are interconverted with a rotation barrier of ΔG*258 = 52.3 ± 1 kJ · mol-1.

ÜbergangsmetaU-Schwefelylid-Komplexe, XI [1] Struktur und Reaktivität von n5 -Thiacyclohexadienyl-1-oxid-chrom-KompIexeii / Transition Metal Sulfur Ylide Complexes, XI [1] Structure and Reactivity of n5-Thiacyclohexadienyl-1-oxide Complexes of Chromium

1981 ◽  
Vol 36 (2) ◽  
pp. 198-204 ◽  
Author(s):  
Lothar Weber ◽  
Dorothee Vehreschild-Yzermann ◽  
Carl Krüger ◽  
Gotthelf Wolmershäuser
Keyword(s):  
Molecular Structure ◽  
Transition Metal ◽  
Crystal And Molecular Structure ◽  
X Ray ◽  
Sulfur Ylide ◽  
Ylide Complexes

Abstract The X-ray crystal and molecular structure of tetraethylammonium-tricarbonyl-(3,5-diphenylthiacyclohexadienyl-1-oxide)chromate has been determined. This organo-metallic anion can be nitrosylated to yield neutral [n5-C5H3(C6H5)2SO](CO)2(NO)Cr. Further carbonyl displacement in this compound is achieved by treatment with pyridin or phosphanes in the presence of triethylamineoxide.

The Crystal and Molecular Structure of trans-Dichloro-mer-trans-bis (triisopropylphosphine)(phosphine)hydridoiridium(III)

1995 ◽  
Vol 48 (7) ◽  
pp. 1277 ◽  
Author(s):  
EJ Ditzel ◽  
GB Robertson
Keyword(s):  
Molecular Structure ◽  
Transition Metal ◽  
Crystal And Molecular Structure ◽  
Structure Refinement ◽  
Monoclinic Space Group ◽  
X Ray Diffraction ◽  
Hydrogen Atoms ◽  
Full Matrix ◽  
X Ray ◽  
Molecular Dimensions

The structure of mer-trans-(PPri3)2(PH3)H-trans-Cl2IrIII (1) (Pri = isopropyl), the second third-row transition-metal-PH3 complex to be so characterized, has been determined by single-crystal X-ray diffraction analysis. Crystals are monoclinic, space group C 2/c with a 21.701(2), b 8.735(1), c 15.594(1) Ǻ, β 119.57(1)° and Z 4. Structure refinement by full-matrix least-squares analysis (2811 reflections, 113 parameters) converged with R = 0.016 and Rw = 0.022. Molecules exhibit crystallographically imposed C2 symmetry. The C2 axis passes through the iridium, hydride and PH3 phosphorus atoms, and requires the PH3 hydrogen atoms to be disordered. Important molecular dimensions are Ir-PPri3 2.371(1) Ǻ, Ir-PH3 2.362(1) Ǻ, Ir-Cl 2.374(1) Ǻ and P- Ir -P(trans) 163.21(3)°.

Neue Bis(phosphan)-nickel(0)-alkin-Komplexe /New Bis(phosphane)-nickel(0)-alkyne Complexes

1985 ◽  
Vol 40 (2) ◽  
pp. 199-209 ◽  
Author(s):  
Klaus R. Pörschke ◽  
Richard Mynott ◽  
Klaus Angermund ◽  
Carl Krüger
Keyword(s):  
Molecular Structure ◽  
Crystal And Molecular Structure ◽  
X Ray ◽  
X Ray Crystallography ◽  
Nmr Data ◽  
Alkyne Complexes

Abstract (Me3P)2Ni(C2H4) (5) and (dmpe) 2Ni2(C2H4)3 (6) react with various alkynes including ethyne (acetylene) and 1-alkynes to form the crystalline compounds (Me3P)2Ni(C2RR′), (dmpe)Ni(C2RR′), and (dmpe)2Ni2(C2R2)2 (R.R′ = H, Me, Ph). Structural assignments were made on the basis of 1H, 13C, and 31P NMR data. The crystal and molecular structure of (dmpe)Ni(C2Ph2) (17) has been determined by X-ray crystallography.

scholarly journals Transition metal complexes with thiosemicarbazide-based ligand: Part 45 - Synthesis, crystal and molecular structure of [2, 6-diacetylpyridine bis(S-methylisothiosemicarbazonato)]diazide-iron(III)

2003 ◽  
Vol 68 (4-5) ◽  
pp. 425-433 ◽  
Author(s):  
Vukadin Leovac ◽  
Vladimir Divjakovic ◽  
Valerija Cesljevic ◽  
Refik Fazlic
Keyword(s):  
Molecular Structure ◽  
Transition Metal ◽  
Transition Metal Complexes ◽  
Equatorial Plane ◽  
Crystal And Molecular Structure ◽  
Crystal Data ◽  
X Ray ◽  
High Spin Complex ◽  
Spin Complex ◽  
Template Reaction

The template reaction of a warm methanolic solution of FeCl3.6H2O S-methylisothiosemicarbazidehydroiodide and 2,6-diacetylpyridine in the presence of LiOAc and NaN3 yielded the high-spin complex [Fe(HL)(N3)2], were HL is the monoanion of the ligand 2,6-diacetylpyridine bis(S-methylisothiosemicarbazone). X-Ray analysis of the complex showed its pentagonal-bipyramidal configuration, with pentadenate (N5) HL in the equatorial plane and two monodentate azide groups in the axial positions. Crystal data are: monoclinic, P21/c,a=1.0263(2), b = 1.2525(2), c = 1.6660(3) nm, ?= 98.94?, V = 2.1154 nm3, Z = 4, ?x = 1.499 g cm-3, ?0 = 1.48 g cm-3, F(000) = 984, ?= 9.40 cm-1.

Gehinderte Ligandbewegungen in Übergangsmetallkomplexen, XLII [1]: Photoreaktionen von Hexacarbonyl-μ-η5:5-fulvalen-dimolybdän und -diwolfram mit konjugierten Dienen / Hindered Ligand Movements in Transition Metal Complexes, XLII [1]: Photoreactions of Hexacarbonyl-μ–η5:5-fulvalene-dimolybdenum and -ditungsten with Conjugated Dienes

1993 ◽  
Vol 48 (11) ◽  
pp. 1635-1650 ◽  
Author(s):  
Cornelius G. Kreiter ◽  
Wolfgang Conrad ◽  
Reiner Exner
Keyword(s):  
Molecular Structure ◽  
Transition Metal ◽  
Diffraction Analysis ◽  
Transition Metal Complexes ◽  
Energy Barrier ◽  
Crystal And Molecular Structure ◽  
Conjugated Dienes ◽  
Photochemical Reactions ◽  
X Ray Diffraction ◽  
X Ray

Photochemical reactions of hexacarbonyl-μ-η5:5-fulvalene-dimolybdenum (1) with 1,3-butadiene (a), 2-methyl-1,3-butadiene (b), E-1,3-pentadiene (c), 2,3-dimethyl-1,3-butadiene (d), and E-3-methyl-1,3-pentadiene (e) yield the corresponding tetracarbonyl-η4-s-cisdiene-μ-η5:5-fulvalene-dimolybdenum complexes 3a-3e. In addition to 3a also η4-s-trans1,3-butadiene-tetracarbonyl-μ-η5:5-fulvalene-dimolybdenum (4) is formed. Similarily hexacarbonyl-μ-η5:5-fulvalene-ditungsten (2) forms with a and b tetracarbonyl-η4-s-cis-diene-μ-η5:5-fulvalene-ditungsten (5a, 5b) and bis(η4-s-cis-1,3-butadiene)-dicarbonyl-μ-η5:5-fulvalene-ditungsten (6). The complexes 3b —3e and also 5b are obtained as mixtures of the o- and u-isomers. Only for tetracarbonyl-η4-cis-2,3-dimethyl-1,3-butadiene-μ-η5:5-fulvalene-dimolybdenum (3d) an interconversion of the o- and u-isomers is observed with an energy barrier of ΔG183# = 73.9 kJ/mol. Both isomers of 3d show hindered inversions with energy barriers of ΔG#313 = 66.1 kJ/mol (u-3d) and ΔG183# = 36.4 kJ/mol (o-3d). For o-3d the crystal and molecular structure was determined by an X-ray diffraction analysis. Hexacarbonylµ — η5:5-bis(cyclopentadiendiyl)methane-dimolybdenum (7), hexacarbonyl-μ-η5:5-bis(cyclopentadiendiyl)ethane-dimolybdenum and hexacarbonyl-μ-η5:5-bis(cyclopentadiendiyl)propane-dimolybdenum do not react with conjugated dienes. Upon UV irradiation 7 looses CO and forms by dimerization octacarbonyl-bis(μ-η5:5-(cyclopentadiendiyl-cyclopentadien-triyl)methane)-dihydrido-tetramolybdenum (8).

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