Crystal Structure of Dibromo(η4-1,5-cyclooctadiene)palladium(II)

1996 ◽  
Vol 61 (9) ◽  
pp. 1335-1341 ◽  
Author(s):  
Petr Štěpnička ◽  
Ivana Císařová
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Single Crystal ◽  
Boat Conformation ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray ◽  
Square Planar ◽  
Twisted Boat

The crystal structure of [(η4-C8H12)PdBr2] has been determined by a single crystal X-ray diffraction with R = 3.82% for 2 147 independent diffractions. The compound crystallizes with the symmetry of orthorhombic space group P212121 (No. 19) within the following parameters: a = 7.0785(5) Å, b = 11.1896(9) Å, c = 12.514(1) Å, V = 991.2(1) Å3, Z = 4. The square planar arrangement of ligands around Pd(II) is distorted due to the steric requirements of 1,5-cyclooctadiene in a twisted boat conformation. Formula units are joined by the weak C2-H2...Br1(1 + x, y, z) hydrogen bonds.

scholarly journals β-Y(BO2)3 – a new member of the β-Ln(BO2)3 (Ln=Nd, Sm, Gd–Lu) structure family

2017 ◽  
Vol 72 (12) ◽  
pp. 983-988 ◽  
Author(s):  
Martin K. Schmitt ◽  
Hubert Huppertz
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Lattice Parameters ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray

Abstractβ-Y(BO2)3 was synthesized in a Walker-type multianvil module at 5.9 GPa/1000°C. The crystal structure has been elucidated through single-crystal X-ray diffraction. β-Y(BO2)3 crystallizes in the orthorhombic space group Pnma (no. 62) with the lattice parameters a=15.886(2), b=7.3860(6), and c=12.2119(9) Å. Its crystal structure will be discussed in the context of the isotypic lanthanide borates β-Ln(BO2)3 (Ln=Nd, Sm, Gd–Lu).

The X-Ray Crystal Structure of 1,2-3,4-Di-O-isopropylidene-4-C-methylthiomethoxy-β-L-arabino-hexoseptanos-5-ulose

1990 ◽  
Vol 43 (12) ◽  
pp. 2083 ◽  
Author(s):  
DC Craig ◽  
VJ James ◽  
JD Stevens
Keyword(s):  
Crystal Structure ◽  
Title Compound ◽  
Membered Ring ◽  
Boat Conformation ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray

The crystal structure of the title compound (1) has been determined by X-ray diffraction. Crystals of (1) are orthorhombic, space group P21212 with a 11.425(1), b 24.916(1), c 5.8952(3)Ǻ, Z 4. Refinement on 1675 observed reflections measured with Cu Kα radiation converged at R 0.034. The seven- membered ring adopts a boat conformation in which the pseudo plane of symmetry passes through the ring oxygen.

Die Kristallstruktur von [Ca(N3)2(H2O)2] · C6H14N4 bei 100 K /The Crystal Structure of [Ca(N3)2(H2O)2] · C6H14N4 at 100 K

1989 ◽  
Vol 44 (2) ◽  
pp. 135-138 ◽  
Author(s):  
Franz A. Mautner ◽  
Harald Krischner ◽  
Christoph Kratky
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Water Molecules ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray

Abstract The crystal structure of calcium azide dihydrate trans-bicyclo-[4.4.0]-1,4,6.9-tetraazadecane has been determined by single crystal X-ray diffraction at 100 K. [Ca(N3)2(H2O)2 (C6H14N4 crystallizes in the orthorhombic space group Pnma, Z = 4. with a - 1396.6(5), b = 1407.1(5), c = 712.2(2) pm. Calcium is hexacoordinated to four azide groups and two water molecules. The elongated octahedra are linked via μ(1,3)-bridging azide ions to form monolayers parallel to the ac-plane. The C6H14N4 molecules are arranged between these layers.

Interaction between Acetyltetralone and Cu(II) Ions: X-Ray Diffraction of the Ligand and Single Crystal ESR Study of the Complex

1983 ◽  
Vol 38 (7) ◽  
pp. 830-834 ◽  
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Single Crystals ◽  
Structure Study ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
X Ray ◽  
Crystal Matrix ◽  
Present Complex ◽  
Square Planar

Abstract Single crystals of acetyltetralone grown from a solution containing a small amount of Cu(II) ions are studied by ESR. The corresponding g, 63Cu magnetic and quadrupolar hyperfine tensors are obtained and are consistent with the trapping of a square planar copper(II) complex. X-ray diffraction shows that pure acetyltetralone crystallizes in the orthorhombic space group Pbca (a - 8.893 Å, b = 20.301 Å, c = 10.715 Å). Comparison of the ESR eigenvectors with the bond directions obtained from this crystal structure study shows that the Cu(II) complex experiences some constraint from the crystal matrix. The present complex is a model for one of the complexation sites of tetracyclines.

Kristallstruktur von MgSO3·H2O/Crystal Structure of Mg SO3·H2O

1998 ◽  
Vol 53 (2) ◽  
pp. 131-134 ◽  
Author(s):  
Willi Buchmeier ◽  
Bernward Engelen ◽  
Holger Müller
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Single Crystal ◽  
X Ray Diffraction ◽  
Space Group ◽  
X Ray

Abstract The crystal structure of MgSO3·H2O , space group P21 /ln, Z = 4, Dx = 2.415 g·cm-3 , a = 4.699(1), b = 12.751(3), c = 5.618(1) Å, β = 90.49(3)°, was determined by single crystal X-ray diffraction. MgSO3·H2O crystallizes in the MnSO3·H2O type. The structure consists of buckled trans layers ∞[MgSO3·H2O], which are built up from strongly distorted MgO5(H2O) octahedra sharing four equatorial vertices, and of trigonal pyramidal SO32- ions. It is close­ly related to the structures of orthorhombic MnSeO3·D2O and monoclinic ZnSeO3·H2O . The Mg-O distances range from 2.051(3) to 2.175(4) Å. The S-O distances (1.543(3), 1.547(3) and 1.493(3) Å) and the O-S-O angles (98.4(2) and 2x 106.0(2)°) correspond to those in MnSO3·H2O . The distortion of the MO5(H2O) octahedra (M = Mg, Mn) and of the SO32- ions is smaller in MgSO3·H2O , but with greater deviations from m symmetry. The distances between the H-connected ∞2[MSO3·H2O] layers are greater in MgSO3·H2O , indicating weaker inter-layer hydrogen bonds. The lateral arrangement of the ∞2[MSO3·H2O] layers is nearly the same in both sulfite monohydrates.

Two new organic-selenate salts: syntheses and crystal structures of bis(di-iso-propylammonium) selenate and di-n-butylammonium hydrogenoselenate

2017 ◽  
Vol 72 (6) ◽  
pp. 425-432
Author(s):  
Waly Diallo ◽  
Libasse Diop ◽  
Cheikh Abdoul Khadir Diop ◽  
Laurent Plasseraud ◽  
Hélène Cattey
Keyword(s):  
Crystal Structure ◽  
Nmr Spectroscopy ◽  
Hydrogen Bonds ◽  
Single Crystal ◽  
Elemental Analysis ◽  
X Ray Diffraction ◽  
Monoclinic System ◽  
Space Group ◽  
X Ray ◽  
Structural Characterizations

AbstractTwo new dialkyammonium selenate salts [i-Pr2NH2]2[SeO4] (1) and [n-Bu2NH2][HSeO4] (2) have been isolated and characterized by single-crystal X-ray diffraction. Salt 1 crystallizes in the monoclinic system, space group P21/n with a=8.7190(5), b=8.8500(4), c=22.5953(9) Å, β=94.6290(17)°, V=1737.84(14) Å3 and Z=4. Salt 2 crystallizes in the monoclinic system space group P21/n with a=10.9328(9), b=8.1700(6), c=13.8095(11) Å, β=97.130(3)°, V=1223.94(17) Å3 and Z=4. In both salts, dialkylammonium cations and selenate anions are connected through NH···O and OH···O hydrogen bonds. In the crystal structure, 1 and 2 are organized in layer-like arrangements. Structural characterizations were completed by infrared and 1H, 13C{1H} and 77Se NMR spectroscopy and elemental analysis which corroborate the X-ray elucidations.

Die Kristallstruktur von [Mg(H2O)6](N3)2 / The Crystal Structure of [Mg(H2O)6](N3)2

1986 ◽  
Vol 41 (8) ◽  
pp. 935-937 ◽  
Author(s):  
Franz A. Mautner ◽  
Harald Krischner ◽  
Christoph Kratky
Keyword(s):  
Crystal Structure ◽  
Oxygen Atom ◽  
Single Crystal ◽  
Water Molecules ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray ◽  
Metal Atoms

Abstract The crystal structure of [Mg(H2O)6](N3)2 was determined by single crystal X-ray diffraction (421 independent observed MoKα-counter reflections. R = 0.037). The crystals are orthorhombic, space group Fmmm, Z = 4, a = 644.3(1), b = 1134.4(1), c = 1333.5(3) pm. The magnesium atoms are octahedrally coordinated to six oxygen atom s of water molecules, the azide groups are not coordinated to metal atoms, N -N = 117.0(2) pm.

Synthese und Kristallstruktur von Bis(m-aminobenzonitril)- diquecksilber(I)-dinitrat/Synthesis and Crystal Structure of Bis(m-aminobenzonitrile)dimercury(I)-dinitrate

1992 ◽  
Vol 47 (4) ◽  
pp. 460-464 ◽  
Author(s):  
Klaus Brodersen ◽  
Jürgen Hofmann
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Single Crystal ◽  
Amino Nitrogen ◽  
X Ray Diffraction ◽  
Triclinic Space Group ◽  
Synthesis And Crystal Structure ◽  
Space Group ◽  
X Ray

The structure of bis(m-aminobenzonitrile)dimercury(I) dinitrate, [Hg2(m -NH2C6H4CN)2](NO3)2 has been determined by single crystal X-ray diffraction techniques and refined to an Rw-value of 0.022. The crystals are triclinic, space group P1 with a = 5.4878(1) Å, b = 8.4085(1) Å, c = 9.6062(1) Å, α = 92.599(3)°, β = 94.763(3)°, γ = 89.614(3)° and Z = 1.The Hg22+-ion [Hg-Hg 2.524(1) Å] is approximately axially coordinated to amino nitrogen atoms [Hg - N 2.209(4) Å, Hg - Hg - N 169.5(3)°]. Additional amino hydrogen bonds to oxygen are building chains along the b-axis containing units of L - Hg - Hg - L groups.

Darstellung und Kristallstruktur von Bis(triphenylphosphin)-decahydro-hypho-hexaboran [(PPh3)2B6H10]·CH2Cl2 / Synthesis and Crystal Structure of Bis(triphenylphosphine)-decahydro-hypho-hexaborane[( PPh3)2B6H10]CH2Cl2

1998 ◽  
Vol 53 (11) ◽  
pp. 1326-1328 ◽  
Author(s):  
T. Schaper ◽  
W. Preetz
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Diffraction Analysis ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Synthesis And Crystal Structure ◽  
Space Group ◽  
X Ray

By reaction of [B6H6]2- with (PPh3)3AgCl in dichloromethane the belt-shaped hypho-hexaborane adduct [(PPh3)2B6H10] is formed. The crystal structure of [(PPh3)2B6H10]·CH2Cl2 has been determined by single crystal X-ray diffraction analysis: orthorhombic, space group Pbnb with a = 9.804(3), b = 17.864(4), c = 21.334(2) Å, Z = 4.

Synthese und Röntgenstrukturanalyse von Ba4LiCuO4(CO3)2 / Synthesis and X-Ray Analysis of Ba4LiCuO4(CO3)2

1995 ◽  
Vol 50 (1) ◽  
pp. 56-60 ◽  
Author(s):  
G. Tams ◽  
Hk. Müller-Buschbaum
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Single Crystals ◽  
X Ray Diffraction ◽  
Laser Technique ◽  
Space Group ◽  
X Ray ◽  
Square Planar ◽  
Group D ◽  
Related Compounds

Single crystals of Ba4LiCuO4(CO3)2 have been prepared by CO2—LASER technique and investigated by single crystal X-ray diffraction. The compound crystallizes in the tetragonal space group D112d—I4̄2m (No. 121), a = 5.767(1), c = 15.2614(7) Å, Z = 2. It is isotypic with Ba4NaCuO4(CO3)2 and shows Li+ with octahedral and Cu3+ with square planar coordination by O2-. The crystal structure are discussed with respect to the related compounds Ba4NaAuO4(O2)2 and Ba4KAuO4(C2)2.

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