Kristallstruktur von MnSO3 • H2O , eine fastsymmetrische schichtstruktur / Crystal structure of MnSO3 • H2O, a nearly symmetrical layer structure

1994 ◽  
Vol 49 (9) ◽  
pp. 1272-1276 ◽  
Author(s):  
Bernward Engelen
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Layer Structure ◽  
Structure Type ◽  
Space Group ◽  
Weak Hydrogen Bonds ◽  
Unknown Structure ◽  
Sulfite Ions

The crystal structure of MnSO3H2O , space group P21/n, Z = 4. Dx = 2.842(2) g · cm-3, a = 4.843(3), b = 12.807(6), c = 5.762(4) Å, β = 90.39(4)° has been determined. MnSO3·H2O crystallizes in a hitherto unknown structure type, which is closely related to that of orthorhombic MnSeO3· D2O. Coordination of Mn is octahedral involving O atom s from one water moleculeo and four different sulfite ions. The Mn-O distances range from 2.136(3) to 2.285(3)Å . The S-O distances are 1.552(3), 1.556(3) and 1.482(3)!Å. The MnO6 octahedra form layers parallel (010) by sharing four equatorial vertices. The layers are connected by weak hydrogen bonds and shifted laterally by 0.7 Å from the arrangement with m symmetry, found in MnSeO3·D2O. Due to this shift, the water molecule is asymmetrically bonded, as shown by both the O-H···O distances (2.967(4)-3.834(5)Å) and the OD stretching modes (2554 and 2576 cm-1) of partly deuterated samples

Spezielle Alkylammoniumhexachlorometallate, III [1] Synthese und Kristallstruktur von Tris(guanidinium)- hexachlororhodat(III)-monohydrat, [C(NH2)3]3 [RhCl6] · H2O / Alkylammonium Hexachlorometallates, III [1] Synthesis, and Crystal Structure of Tris(guanidinium) Hexachlororhodate(III) Monohydrate, [C(NH2)3]3[RhCl6] · H2O

1996 ◽  
Vol 51 (10) ◽  
pp. 1464-1468 ◽  
Author(s):  
Walter Frank ◽  
Guido J. Reiß
Keyword(s):  
Crystal Structure ◽  
Hydrochloric Acid ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Acid Solution ◽  
Hydrochloric Acid Solution ◽  
Guanidine Hydrochloride ◽  
Triclinic Space Group ◽  
Synthesis And Crystal Structure ◽  
Space Group

Tris(guanidinium) hexachlororhodate(III) monohydrate, [C(NH2)3]3[RhCl6] · H2O (1 ) has been obtained by the reaction of rhodium(III) chloride with guanidine hydrochloride in hydrochloric acid solution. 1 crystallizes in the triclinic space group P1̅ (a = 7.6013(9) Å, b = 8.6912(10) Å, c = 15.956(2) Å, α = 93.177(10)°, β = 101.691(10)°, γ = 113.995(9)°, V = 931.8(2), Z = 2). Two crystallographically independent hexachlororhodate ions, three crystallographically independent guanidinium ions and one water molecule are linked by a complex framework of hydrogen bonds.

Zur Synthese und Kristallstruktur von Dibariumkaliumtrizinkborat Ba2KZn3(B3O6)(B6O13)/Synthesis and Crystal Structure of Di-barium Potassium Tri-zinc Borate Ba2KZn3(B3O6)(B6O13)

1996 ◽  
Vol 51 (3) ◽  
pp. 319-324 ◽  
Author(s):  
Silke Busche ◽  
Karsten Bluhm
Keyword(s):  
Crystal Structure ◽  
Single Crystals ◽  
Structure Type ◽  
Lattice Parameters ◽  
Zinc Borate ◽  
Synthesis And Crystal Structure ◽  
Space Group ◽  
X Ray ◽  
Unknown Structure

Abstract Single crystals of the new compound Ba2KZn3(B3O6)(B6O13) were obtained by using a B2O3 flux technique; they crystallize in an as yet unknown structure type. X-ray investigations led to the space group Ci1-P1̄ (Nr.2) with lattice parameters a = 705.2(2), b = 712.5(2), c = 1880.3(6), a = 93.43(3)°, β = 90.72(2)°, γ = 119.57(2)°, Z = 2. The structure contains (B3O6)3--rings and a new discrete (B6O13)8- anion, which is composed of two BO4 and two B2O5 units. Zn2+ is tetrahedrally coordinated by oxygen and two out of three tenfold coordinated Ba-sites are statistically occupied by Ba2+ and K+.

scholarly journals Crystal structure of strontium thiosulfate monohydrate

2020 ◽  
Vol 76 (2) ◽  
pp. 197-200
Author(s):  
Wilhelm Klein
Keyword(s):  
Crystal Structure ◽  
Aqueous Solution ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Space Group ◽  
Monodentate Ligands

SrS2O3·H2O was obtained from an aqueous solution of Na2S2O3 and Sr(NO3)2 and crystallizes in space group P\overline{1} with all atoms at general positions. The Sr2+ ion exhibits an [8 + 1] coordination defined by two terminal S and six O atoms of thiosulfate ions, one of the latter at a longer distance, and by one O atom of a water molecule. Two thiosulfate anions act as bidentate, four as monodentate ligands. The structure consists of mainly ionically interacting layers lying parallel to the crystallographic ab plane. The layers are connected by O—H...S and O—H...O hydrogen bonds of moderate strength.

Synthese und Kristallstruktur von Dibariumzink-bis(cyclotriborat) Ba2Zn(B3O6)2/Synthesis and Crystal Structure of Di-barium Zinc Bis-cyclotriborate Ba2Zn(B3O6)2

1996 ◽  
Vol 51 (3) ◽  
pp. 309-312 ◽  
Author(s):  
Silke Busche ◽  
Karsten Bluhm
Keyword(s):  
Crystal Structure ◽  
High Temperature ◽  
Single Crystals ◽  
Crystal Structures ◽  
Structure Type ◽  
Lattice Parameters ◽  
Synthesis And Crystal Structure ◽  
Space Group ◽  
X Ray ◽  
Unknown Structure

Abstract Single crystals of the new compound Ba2Zn(B3O6)2 were obtained by using a B2O3 flux technique. They crystallize in an as yet unknown structure type. X-ray investigations led to space group Ci1-P1̄ (Nr.2) with lattice parameters a = 715.5(2), b = 720.5(2), c = 1178.9(4), a = 78.96(2)°, β = 85.45(2)°, γ = 60.12(1)°, Z = 2. The structure is characterized by iso­lated (B3O6)3--rings and contains two ninefold coordinated Ba-sites. Zn2+ is tetrahedrally coordinated by oxygen. The relation to the crystal structures of high-temperature BaB2O4 and Ba2Ca(B3O6)2 is discussed.

scholarly journals Crystal structure of aqua(1H-pyrazole-κN2)(pyridine-2,6-dicarboxylato-κ3O2,N,O6)copper(II) dihydrate

2017 ◽  
Vol 73 (12) ◽  
pp. 1875-1877
Author(s):  
Daeyoung Kim ◽  
Sung Kwon Kang
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Layer Structure ◽  
Complex Molecule ◽  
Water Ligand ◽  
Water Molecules ◽  
Apical Position ◽  
Pyramidal Geometry ◽  
Square Pyramidal Geometry

In the title compound, [Cu(C7H3NO4)(C3H4N2)(H2O)]·2H2O, the CuIIatom is coordinated by three O atoms and two N atoms, provided by a tridentate pyridine-2,6-dicarboxylate (pdc), one pyrazole and one water ligand, forming a slightly distorted square-pyramidal geometry [range of O—Cu—O and O—Cu—N bond angles = 79.55 (8)–166.22 (10)°]. The water molecule is positioned at the apical position. In the crystal, the complex molecule and the two crystallographically independent non-coordinating water molecules are linked into a supramolecular layer structure parallel to theabplaneviaO—H...O and N—H...O hydrogen bonds.

[Ni(NH3 )6]S04 : Kristallstruktur und Infrarotspektren / [Ni(NH3)6]SO4: Crystal Structure and Infrared Spectra

1999 ◽  
Vol 54 (7) ◽  
pp. 843-848 ◽  
Author(s):  
Christoph Mockenhaupt ◽  
Ralf Eßmann ◽  
Heinz Dieter Lutz
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Infrared Spectra ◽  
Structure Type ◽  
Site Symmetry ◽  
X Ray Diffraction ◽  
Orientational Disorder ◽  
X Ray ◽  
Unknown Structure ◽  
Ir Bands

The crystal structure of [Ni(NH3)6]SO4 has been determined by single-crystal X-ray diffraction (P21/c; Z = 4; a = 705.0(1), b = 1195.2(2), c = 1180.0(2) pm, β = 96.14(3)°; 2271 reflections; R1 = 3.94%). In the hitherto unknown structure type, both the [Ni(NH3)6]2+ and the SO42- ions form chains along [100], The six crystallographically different ammine ligands of the distorted [Ni(NH3)6]2+ octahedra are involved in hydrogen bonds to six crystallographically equivalent SO42- ions (site symmetry C1). The strength of the hydrogen bonds differs strongly (νOD of matrix isolated NH2D molecules: 2378 - 2494 cm-1 , N ∙∙∙ O distances: 272 - 340 pm). The temperature evolution of the IR bands reveals the decrease of the dynamic orientational disorder of the NH3 molecules with decreasing temperature.

Addukte Aromat/Chlorwasserstoff bei tiefen Temperaturen: Beiträge zu Bildung und Kristallstruktur [1] / Adducts Arene/Hydrogen Chloride at Low Temperatures: Contributions to Formation and Crystal Structure [1]

1993 ◽  
Vol 48 (5) ◽  
pp. 571-576 ◽  
Author(s):  
Axel Deeg ◽  
Dietrich Mootz
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Crystal Structures ◽  
Hydrogen Chloride ◽  
Low Temperatures ◽  
Unit Cell ◽  
Aromatic System ◽  
Space Group ◽  
Weak Hydrogen Bonds

The melting diagrams of the systems benzene-HCl, toluene-HCl and mesitylene-HCl have been established and the crystal structures of two adducts determined. The adduct toluene · 2 HCl, melting incongruently at -115°C, is monoclinic with space group C2/c and Ζ = 4 formula units per unit cell; the adduct mesitylene · HCl, m. p. -64°C, is orthorhombic with space group Pbca and Ζ = 8. The HCl molecules are situated on both sides and one side, respectively, of the plane of the aromatic system and are linked to it by weak hydrogen bonds of the type Cl-H···π.

scholarly journals Crystal structure of N′-[2-(benzo[d]thiazol-2-yl)acetyl]benzohydrazide, an achiral compound crystallizing in space group P1 with Z = 1

2021 ◽  
Vol 77 (9) ◽  
Author(s):  
Rasha A. Azzam ◽  
Galal H. Elgemeie ◽  
Mona M. Seif ◽  
Peter G. Jones
Keyword(s):  
Crystal Structure ◽  
Organic Compound ◽  
Nitrogen Atom ◽  
Hydrogen Bonds ◽  
Layer Structure ◽  
The Other ◽  
Hydrogen Atoms ◽  
Space Group ◽  
Compound C ◽  
C And N

In the molecule of the title compound, C16H13N3O2S, one hydrazinic nitrogen atom is essentially planar, but the other is slightly pyramidalized. The torsion angle about the hydrazinic bond is 66.44 (15)°. Both hydrazinic hydrogen atoms lie antiperiplanar to the oxygen of the adjacent carbonyl group. The molecular packing is a layer structure determined by two classical hydrogen bonds, N—H...O=C and N—H...Nthiazole. The space group is P1 with Z = 1, which is unusual for an achiral organic compound.

Crystal Structure, NQR and DSC Studies of Tetrabromocadmates(II): [4-H2NC5H4NH]2CdBr4 · H2O and [2,3,5,6-(CH3)4C4N2H2]CdBr4

2008 ◽  
Vol 63 (10) ◽  
pp. 1181-1186 ◽  
Author(s):  
Naoko Hatano ◽  
Michio Nakashima ◽  
Keizo Horiuchi ◽  
Hiromitsu Terao ◽  
Hideta Ishihara
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Intensity Ratio ◽  
Crystal Structure Data ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
Thermal Anomalies ◽  
Dsc Studies ◽  
Dsc Measurements

Abstract4-Aminopyridinium tetrabromocadmate(II) monohydrate (1) crystallizes in the orthorhombic space group Pbcm with a = 6.876(2), b = 14.089(2), and c = 18.845(2) Å , Z = 4, T = 296 K. In the crystal structure, a [CdBr4]2− anion, a 4-aminopyridinium cation, and a water molecule are alternately connected into chains by hydrogen bonds N-H···Br and O-H···Br. 2,3,5,6- Tetramethylpyrazinium tetrabromocadmate(II) (2) crystallizes in the orthorhombic space group P212121 with a = 14.640(12), b = 15.615(7), c = 6.686(5) Å , Z = 4, T = 296 K. In the crystal structure, a [CdBr4]2− anion and a 2,3,5,6-tetramethylpyrazinium cation are interconnected by bifurcated hydrogen bonds N-H· · ·2Br and form infinite chains. 81Br NQR spectra with three lines with an intensity ratio of 1 : 1 : 2 (77 K ≤ T ≤ ca. 325 K) and four lines with an intensity ratio of 1 : 1 : 1 : 1 (77 K ≤ T ≤ ca. 330 K) were observed for crystalline 1 and 2, respectively, which are consistent with the crystal structure data. DSC measurements showed the existence of thermal anomalies at high temperatures in both 1 and 2.

Synthesis, Crystal Structure And Spectroscopic Studies Of A Mixed Ligand Copper (Ii) Complex: Trans-Bis(Succinimidato)-Bis(Benzylamino)Cu(Ii)

2006 ◽  
Vol 61 (8) ◽  
pp. 979-982 ◽  
Author(s):  
Murat Taş ◽  
Hanife Saraçoğlu ◽  
Hümeyra Bati ◽  
Nezihe Çalışkan ◽  
Orhan Büyükgüngör
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Spectroscopic Studies ◽  
Mixed Ligand ◽  
Interplanar Angle ◽  
Space Group ◽  
Square Planar

The molecules of the title compound, [Cu(C11H13N2O2)2], lie across centres of inversion in space group P21/c and are linked by intermolecular N-H···O and C-H···O hydrogen bonds. The central Cu atom has a slightly distorted square-planar coordination comprised of four N atoms. Cu-N bond distances are 1.975(2) and 2.020(2) Å . The interplanar angle between the phenyl and succinimidato ring is 87.34(10)°

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