Synthesis, spectroscopic study, and crystal structure of a new organotin(IV) selenate derivative

2018 ◽  
Vol 41 (5-6) ◽  
pp. 183-188
Author(s):  
Waly Diallo ◽  
Libasse Diop ◽  
Cheikh Abdoul Khadir Diop ◽  
Hélène Cattey ◽  
Laurent Plasseraud
Keyword(s):  
Crystal Structure ◽  
Mass Spectrometry ◽  
Three Dimensional ◽  
Resonance Spectroscopy ◽  
Zigzag Chain ◽  
X Ray Diffraction ◽  
Oh Groups ◽  
Orthorhombic System ◽  
X Ray ◽  
Dimensional Network

Abstract The polymeric organotin(IV) selenate complex [(Me3Sn)3(SeO4)(OH)]n (1) has been isolated as single crystals from the reaction of [(Me2NH2)2SeO4] and Me3SnCl in methanol. In the solid state, compound 1 was characterized by X-ray diffraction analysis, Fourier transform-infrared spectroscopy, and elemental analysis. 1 crystallizes in the orthorhombic system space group Pbca with a=11.0231(2) Å, b=16.3461(3) Å, c=20.9945(4) Å, α=β=γ=90°, V=3782.89(12) Å3, and Z=8. Its structure can be described as a polymeric zigzag chain based on Me3Sn moieties linked by tridentate selenate anions. Pendant (Me3Sn)2OH groups are also connected to the chain, according to a syndiotactic organization, and via Sn-O-Se bonds. Intermolecular OH···O hydrogen bonds and long Se-O···Sn distance interactions promote the association of chains together and lead to the propagation of a three-dimensional network. In addition, the behavior of 1 in solution (methanol) was also studied by multinuclear nuclear magnetic resonance spectroscopy and mass spectrometry.

Crystal and Molecular Structure of 3-Iodo-2-propynyl-N-butylcarbamate

1997 ◽  
Vol 52 (2) ◽  
pp. 256-258 ◽  
Author(s):  
Evgeni V. Avtomonov ◽  
Rainer Grüning ◽  
Jörg Lorberth
Keyword(s):  
Molecular Structure ◽  
Crystal Structure ◽  
Title Compound ◽  
Crystal And Molecular Structure ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
X Ray ◽  
Dimensional Network ◽  
Carbamate Group ◽  
Oxygen Atoms

Abstract The crystal structure of the title compound has been determined by X-ray diffraction methods. Due to the Lewis acidic character of the iodine substituent a “zig-zag” chain is formed via intermolecular interactions (2.933(4) A) between iodine and oxygen atoms of theocarbamate moiety. A three-dimensional network is formed through hydrogen-bridging (2.04 A) between NH-groups and the oxygen atoms of the neighbouring carbamate group of the next molecule.

scholarly journals Synthesis, crystal structure and charge-distribution validation of a new alluaudite-type phosphate, Na2.22Mn0.87In1.68(PO4)3

2020 ◽  
Vol 76 (8) ◽  
pp. 1369-1372
Author(s):  
Abdessalem Badri ◽  
Inmaculada Alvarez-Serrano ◽  
María Luisa López ◽  
Mongi Ben Amara
Keyword(s):  
Crystal Structure ◽  
Single Crystals ◽  
Three Dimensional ◽  
Structure Type ◽  
X Ray Diffraction ◽  
Flux Method ◽  
X Ray ◽  
Coordination Numbers ◽  
Dimensional Network ◽  
Anionic Framework

Na2.22Mn0.87In1.68(PO4)3, sodium manganese indium tris(phosphate) (2.22/0.87/1.68), was obtained in the form of single crystals by a flux method and was structurally characterized by single-crystal X-ray diffraction. The compound belongs to the alluaudite structure type (space group C2/c) with general formula X(2)X(1)M(1)M(2)2(PO4)3. The X(2) and X(1) sites are partially occupied by sodium [occupancy 0.7676 (17) and 1/2] while the M(1) and M(2) sites are fully occupied within a mixed distribution of sodium/manganese(II) and manganese(II)/indium, respectively. The three-dimensional anionic framework is built up on the basis of M(2)2O10 dimers that share opposite edges with M(1)O6 octahedra, thus forming infinite chains extending parallel to [10\overline{1}]. The linkage between these chains is ensured by PO4 tetrahedra through common vertices. The three-dimensional network thus constructed delimits two types of hexagonal channels, resulting from the catenation of M(2)2O10 dimers, M(1)O6 octahedra and PO4 tetrahedra through edge- and corner-sharing. The channels are occupied by Na+ cations with coordination numbers of seven and eight.

Synthesis, crystal structure and topological analysis of a three-dimensional polymeric network based on zinc(II), potassium and 5-sulfobenzene-1,3-dicarboxylate (SIP)

2018 ◽  
Vol 74 (8) ◽  
pp. 981-985
Author(s):  
Flávia H. Silva ◽  
Chris H. J. Franco ◽  
Charlane C. Corrêa ◽  
Renata Diniz
Keyword(s):  
Crystal Structure ◽  
Topological Analysis ◽  
Three Dimensional ◽  
Strong Interactions ◽  
Monoclinic Space Group ◽  
X Ray Diffraction ◽  
X Ray ◽  
Structural Rigidity ◽  
Dimensional Network ◽  
Point Symbol

Aromatic polycarboxylate linkers provide structural rigidity and strong interactions among the metal centre and the carboxylate O atoms. A new three-dimensional coordination polymer namely, catena-poly[potassium [tetraaqua(μ-5-sulfobenzene-1,3-dicarboxylato)zinc(II)]], {K[Zn(C8H3O7S)(H2O)4]} n or {K[Zn(SIP)(H2O)4]} n , where SIP is 5-sulfobenzene-1,3-dicarboxylate or 5-sulfoisophthalate, was obtained and characterized by elemental analysis and IR vibrational spectroscopy, and the single-crystal structure was determined by X-ray diffraction analysis. The compound crystallizes in the monoclinic space group P21/n with Z = 4. Topological analysis revealed that K—O interactions form a two-dimensional network, which is uninodal 4-connected and can be described with a point symbol (44.62), and this plane network is classified as sql/Shubnikov. The layers are connected by Zn2+ ions coordinated to the SIP linker, forming a three-dimensional network. This net is a trinodal (3,5,6)-connected system with point symbol (3.44.52.62.73.83).(3.44.52.62.7).(3.72).

Crystal Structure of the Pyridinium Salt of the Polymeric Tris(thiocyanato)dicuprate(I) Anion

1979 ◽  
Vol 32 (12) ◽  
pp. 2757 ◽  
Author(s):  
CL Raston ◽  
B Walter ◽  
AH White
Keyword(s):  
Crystal Structure ◽  
Nitrogen Atom ◽  
Single Crystal ◽  
Title Compound ◽  
Three Dimensional ◽  
Pyridinium Salt ◽  
The Other ◽  
X Ray Diffraction ◽  
X Ray ◽  
Dimensional Network

The title compound, [C5H6N]+ [Cu2(SCN)3]-, has been prepared and its crystal structure determined by single-crystal X-ray diffraction at 295(1) K. Crystals are monoclinic, Cc, a 11.238(7), b 11.644(4), c 10.020(4)Ǻ, β 102.67(3)°, Z 4, the structure being refined to a residual of 0.037 for the 960 'observed' reflections. The structure comprises a three-dimensional network of copper(I) atoms linked by bridging thiocyanate groups, the pyridinium counterions occupying sites in the network cavities. Both copper atoms are four-coordinate, one having an environment of one nitrogen atom [Cu-N, 1.926(9)Ǻ] and three sulfur atoms [Cu-S, 2.319(3), 2.421(3), 2.448(3)Ǻ], while the other is coordinated by two atoms of each type [Cu-N, 1.935(9), 1.947(10); Cu-S, 2.430(3), 2.493(4) Ǻ].

scholarly journals Crystal structure of bis[cis-(1,4,8,11-tetraazacyclotetradecane-κ4N)bis(thiocyanato-κN)chromium(III)] dichromate monohydrate from synchrotron X-ray diffraction data

2017 ◽  
Vol 73 (1) ◽  
pp. 72-75 ◽  
Author(s):  
Dohyun Moon ◽  
Masahiro Takase ◽  
Takashiro Akitsu ◽  
Jong-Ha Choi
Keyword(s):  
Crystal Structure ◽  
Three Dimensional ◽  
Complex Salt ◽  
Water Molecules ◽  
X Ray Diffraction ◽  
Intermolecular Hydrogen Bonds ◽  
Rotation Symmetry ◽  
X Ray ◽  
Dimensional Network ◽  
Distorted Octahedral

The structure of the complex salt,cis-[Cr(NCS)2(cyclam)]2[Cr2O7]·H2O (cyclam = 1,4,8,11-tetraazacyclotetradecane, C10H24N4), has been determined from synchrotron data. The asymmetric unit comprises of one [Cr(NCS)2(cyclam)]+cation, one half of a Cr2O72−anion (completed by inversion symmetry) and one half of a water molecule (completed by twofold rotation symmetry). The CrIIIion is coordinated by the four cyclam N atoms and by two N atoms ofcis-arranged thiocyanate anions, displaying a distorted octahedral coordination sphere. The Cr—N(cyclam) bond lengths are in the range 2.080 (2) to 2.097 (2) Å while the average Cr—N(NCS) bond length is 1.985 (4) Å. The macrocyclic cyclam moiety adopts thecis-V conformation. The bridging O atom of the dichromate anion is disordered around an inversion centre, leading to a bending of the Cr—O—Cr bridging angle [157.7 (3)°]; the anion has a staggered conformation. The crystal structure is stabilized by intermolecular hydrogen bonds involving the cyclam N—H groups and water O—H groups as donor groups, and the O atoms of the Cr2O72−anion and water molecules as acceptor groups, giving rise to a three-dimensional network.

The crystal structure and chemistry of the "red salt" α-trisilver-amidoselenate, Ag3NSeO3

1990 ◽  
Vol 68 (9) ◽  
pp. 1606-1610 ◽  
Author(s):  
Vladimir Kocman ◽  
Jan T. Szymański
Keyword(s):  
Crystal Structure ◽  
Structural Unit ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
Threefold Axis ◽  
X Ray ◽  
Dimensional Network ◽  
Crystal Structure And Chemistry ◽  
Silver Atoms ◽  
Nitrogen Bond

The crystal structure of the α-modification of the "red salt" of trisilver amidoselenate, Ag3NSeO3 has been determined from MoKα X-ray diffraction data, and refined to R = 3.19% from 337 unique absorption-corrected observed reflections. The structure is rhombohedral, R3c (No. 161), with (hexagonal) a = 8.462(4), c = 11.372(6) Å. The formula unit has point symmetry 3 (C3), with Se and N on the threefold axis, each approximately tetrahedrally coordinated; Se by three oxygen atoms (at 1.651(8) Å and N (at 1.70(2) Å, and N by Se and three silver atoms (at 2.164(8) Å. The bond of 1.70(2) Å between Se and N is particularly short. The Ag3NSeO3 structural unit bridges to three adjacent units via short Ag … O contacts of 2.23(1) Å to form a three-dimensional network. Keywords: trisilver amidoselenate, selenium–nitrogen bond, X-ray structure.

Structural reinvestigation of the photoluminescent complex [NdCl2(H2O)6]Cl

2013 ◽  
Vol 69 (9) ◽  
pp. 1002-1005 ◽  
Author(s):  
Kuan-Ying Hsieh ◽  
El-Eulmi Bendeif ◽  
Sebastien Pillet ◽  
Abdelatif Doudouh ◽  
Dominik Schaniel ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Local Structure ◽  
Pair Distribution Function ◽  
Structural Model ◽  
Crystal Packing ◽  
Three Dimensional ◽  
Crystalline Material ◽  
X Ray Diffraction ◽  
X Ray ◽  
Dimensional Network

The structure of the photoluminescent compound hexaaquadichloridoneodymium(III) chloride has been redetermined from single-crystal X-ray diffraction data at 100 K, with the aim of providing an accurate structural model for the bulk crystalline material. The crystal structure may be described as a network of [NdCl2(H2O)6]+cations with distorted square-antiprism geometry around the NdIIIcentre. The NdIIIcation and the nonbonded Cl−anion are both located on twofold symmetry axes. The crystal packing consists of three different neodymium pairs linked by a three-dimensional network of O—H...Cl intermolecular interactions. The pair distribution function (PDF) calculated from the experimentally determined structure is used for the discussion of the local structure.

scholarly journals Crystal structure of a 1,1,2,2-tetrachloroethane-solvated hydrazinecarbothioamide compound

2017 ◽  
Vol 73 (9) ◽  
pp. 1271-1274 ◽  
Author(s):  
Sayed Riyadh ◽  
David L. Hughes ◽  
Musa A Said
Keyword(s):  
Crystal Structure ◽  
Tautomeric Form ◽  
Mixed Solvents ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
Azide Group ◽  
X Ray ◽  
H Nmr ◽  
Dimensional Network ◽  
Solvent Molecules

The title compound, [(1-{4-[2-(2,4-dihydroxyphenyl)diazen-1-yl]phenyl}ethylidene)amino]thiourea, 1,1,2,2-tetrachloroethane monosolvate, C15H15N5O2S·C2H2Cl4, was prepared from 4-(4-acetylphenyldiazendiyl)resorcinol and thiosemicarbazide and recrystallized from mixed solvents of tetrachloroethane andn-hexane.1H NMR and X-ray diffraction data are in support of the thione tautomeric form. The X-ray analysis shows the molecule crystallizes as a zwitterion, with proton transfer from the nominal phenol to the azide group; the N—N bond length is 1.291 (5) Å, and an intramolecular N—H...O hydrogen bond is formed. In the crystal, N—H...O, N—H...N and O—H...S hydrogen bonds connect the molecules into a three-dimensional network. The tetrachloroethane solvent molecules are linked to this network through weak C—H...O linkages.

The Crystal Structure of GdZn3

2013 ◽  
Vol 68 (11) ◽  
pp. 1265-1268 ◽  
Author(s):  
Inna Bigun ◽  
Yaroslav M. Kalychak
Keyword(s):  
Crystal Structure ◽  
Coordination Number ◽  
Diffraction Data ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
Space Group ◽  
X Ray ◽  
Type Space ◽  
Dimensional Network

The crystal structure of GdZn3 was refined using singlecrystal X-ray diffraction data: YZn3 type, space group Pnma, Z = 4, a = 6:7250(13), b = 4:4620(9), c = 10:201(2) Å , R1 = 0:049, wR2 = 0:082, 303 F2 values, 25 variables. The zinc atoms build up a three-dimensional network with short Zn-Zn distances, while the Gd atoms are well separated from each other. The coordination number is 17 for Gd, and 10 and 12 for the Zn atoms.

scholarly journals A NOVEL OCTAHEDRAL NIOBIUM OXYCHLORIDE CLUSTER BUILT FROM INTERCONNECTED Nb6Cl12O4 UNITS: Cs2Sc3Nb1227O8

2011 ◽  
Vol 11 (2) ◽  
pp. 109-116
Author(s):  
Fakhili Gulo
Keyword(s):  
Crystal Structure ◽  
Solid State ◽  
Three Dimensional ◽  
Diffraction Method ◽  
X Ray Diffraction ◽  
Stoichiometric Mixture ◽  
Orthorhombic System ◽  
X Ray ◽  
Solid State Route ◽  
Valence Electrons

A novel octahedral niobium cluster oxychloride compound, Cs2Sc3Nb12Cl27O8 was synthesized by solid-state route techniques from stoichiometric mixture of CsCl, Sc2O3, Nb, NbCl5, and Nb2O5, heated at 700 °C for two days. The crystal structure was determined by single crystal X-ray diffraction method. It crystallizes in orthorhombic system with space group of Pnma, a = 17.5206(1) Å, b = 29.6899(3) Å, c = 9.2114(1) Å, and V = 4791.63(8) Å3. The structure is based on  unit in which four oxygen ligands selectively occupy inner positions arranged in sets of three and one on opposite side of the Nb6 octahedron. Each cluster shares three apical-chlorine ligands with three adjacent clusters to form layers with topology similar to that of graphite. The cluster units are also connected to each other by both cesium and scandium atoms to form a three-dimensional framework. This compound exhibits 14 valence electrons per cluster.

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