(N,N,N′,N′′,N′′-Pentamethyldiethylenetriamine-κ3 N,N′,N′′)(trithiocyanurato-κ2 N,S)zinc(II)

2007 ◽  
Vol 63 (3) ◽  
pp. m725-m727
Author(s):  
Jaromír Marek ◽  
Zdeněk Trávníček ◽  
Šárka Čermáková
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Bidentate Ligand ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
Centrosymmetric Dimers ◽  
Close Contacts

The structure of the title compound, [Zn(C9H23N3)(C3HN3S3)], consists of discrete molecules connected by N—H...S hydrogen bonds into centrosymmetric dimers. The ZnII atom is pentacoordinated in a deformed trigonal–bipyramidal geometry by three N atoms of a tridentate N,N,N′,N′′,N′′-pentamethyldiethylenetriamine ligand, and one S and one N atoms of a trithiocyanurate dianion bonded as a bidentate ligand. The crystal structure is further stabilized by close contacts of the types C—H...S and C—H...N.

scholarly journals Dibromido(dimethyl sulfoxide-κO)(6-methyl-2,2′-bipyridine-κ2N,N′)cadmium

2012 ◽  
Vol 68 (8) ◽  
pp. m1124-m1124 ◽  
Author(s):  
Sadif A. Shirvan ◽  
Sara Haydari Dezfuli
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Dimethyl Sulfoxide ◽  
Title Compound ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
Bipyridine Ligand ◽  
Distorted Trigonal Bipyramidal

In the title compound, [CdBr2(C11H10N2)(C2H6OS)], the CdIIatom is five-coordinated in a distorted trigonal–bipyramidal geometry by two N atoms from a 6-methyl-2,2′-bipyridine ligand, one O atom from a dimethyl sulfoxide ligand and two Br atoms. An intramolecular C—H...O hydrogen bond occurs. The crystal structure is stabilized by C—H...Br hydrogen bonds and π–π contacts between the pyridine rings [centroid–centroid distances = 3.582 (5) and 3.582 (5) Å].

Bis(cyclopentenylacetato)tetramethyldistannoxane dimer

2006 ◽  
Vol 62 (5) ◽  
pp. m1167-m1169 ◽  
Author(s):  
Aftab Ahmad ◽  
Azim Khan ◽  
Saqib Ali ◽  
Masood Parvez
Keyword(s):  
Crystal Structure ◽  
Title Compound ◽  
Narrow Range ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
A Value ◽  
Centrosymmetric Dimers ◽  
Distorted Trigonal Bipyramidal

The crystal structure of the title compound, tetra-μ2-(cyclopent-2-enyl)acetato-1:2κ2 O:O′;1:3κ2 O:O′;2:4κ2 O:O′;3:4κ2 O:O′-octamethyl-1κ2 C,2κ2 C,3κ2 C,4κ2 C-di-μ3-oxo-1:2:3κ3 O;2:3:4κ3 O-tetratin(IV), [Sn4(CH3)8(C7H9O2)4O2], is composed of discrete centrosymmetric dimers lying about inversion centres. The cyclopentenylacetate ligand shows different modes of coordination with Sn, as a result of which the central Sn2O2 core is fused with two four-membered (Sn2O2) and two six-membered (Sn2O3C) rings. The endocyclic Sn atoms are six-coordinate in a skew-trapezoidal bipyramidal environment. The exocyclic Sn atoms are five-coordinate and show distorted trigonal–bipyramidal geometry. The Sn—C distances lie in a very narrow range [2.095 (4)–2.113 (4) Å], while the Sn—O distances range between 2.030 (3) and 2.280 (3) Å for strong bonds and a value of 2.654 (3) Å for the relatively weak Sn—O bond.

scholarly journals 2,6-Bis(4-methoxybenzylidene)cyclohexanone

2006 ◽  
Vol 62 (5) ◽  
pp. o1910-o1912 ◽  
Author(s):  
Ray J. Butcher ◽  
H. S. Yathirajan ◽  
B. K. Sarojini ◽  
B. Narayana ◽  
J. Indira
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Photon Absorption ◽  
Intermolecular Hydrogen Bonds ◽  
Two Photon Absorption ◽  
Two Photon ◽  
Compound C ◽  
Centrosymmetric Dimers

The title compound, C22H22O3, demonstrates a two-photon absorption. Its metrical parameters are similar to those of related cyclohexanone derivatives. In the crystal structure, two sets of centrosymmetric dimers formed by weak C—H...O intermolecular hydrogen bonds combine to form molecular tapes along [101].

scholarly journals Crystal structure of dichlorido[2-(diphenylphosphanyl)-3,4,5,6-tetrafluorobenzene-1-thiolato-κ2P,S]gold(III)

2015 ◽  
Vol 71 (10) ◽  
pp. m181-m182
Author(s):  
Peter W. R. Corfield ◽  
Mary Bailey
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Dimer Formation ◽  
Polar Solvents ◽  
Square Planar ◽  
Thiolate Ligand ◽  
Cl Atoms ◽  
Low Solubility ◽  
Centrosymmetric Dimers

The title compound, [Au(C18H10F4PS)Cl2], crystallizes as neutral molecules, with the AuIIIatom coordinated by two Cl atoms and by the P and S atoms of the bidentate phosphanyl thiolate ligand, in a slightly distorted square-planar environment. The molecules are linked into centrosymmetric dimersvialong axial Au—Cl bonds of 3.393 (4) Å. This axial Au—Cl distance is longer than is usually seen, although one other example has been given. Dimer formation may explain the unexpectedly low solubility of the compound in common polar solvents. There is also a separate intermolecular Au—F contact of 3.561 (6) Å, but this distance seems too long to be regarded as a bond. Two putative C—H...F hydrogen bonds appear to link the dimers into sheets parallel to (110). There is a short intermolecular F...F contact of 2.695 (10) Å between two dimers related by the twofold axis.

scholarly journals Crystal structure ofO-ethylN-(ethoxycarbonyl)thiocarbamate

2015 ◽  
Vol 71 (10) ◽  
pp. o782-o783 ◽  
Author(s):  
Matthew J. Henley ◽  
Alex M. Schrader ◽  
Victor G. Young ◽  
George Barany
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Least Squares ◽  
Title Compound ◽  
Compound C ◽  
The One ◽  
Related Compounds ◽  
Centrosymmetric Dimers

The title compound, C6H11NO3S, provides entries to novel carbamoyl disulfanes and related compounds of interest to our laboratory. The atoms of the central O(C=S)N(C=O)O fragment have an r.m.s. deviation of 0.1077 Å from the respective least-squares plane. While several conformational orientations are conceivable, the crystal structure shows only the one in which the carbonyl and the thiocarbonyl moieties areantito each other across the central conjugated C—N—C moiety. Pairs of 2.54 Å N—H...S=C hydrogen bonds between adjacent molecules form centrosymmetric dimers in the crystal.

Die Kristallstruktur von Kalium-bis(hexamethylentetramin)-tris-(isothiocyanato)cuprat(II)-dihydrat, K[Cu(C6H12N4)2(NCS)3] · 2 H2O, einem trigonal-bipyramidalen Kupfer(II) -Komplex / The Crystal Structure of Potassium-bis(hexamethylenetetramine)-tris-(isothiocyanato) cuprate(II )-dihydrate, K[Cu(C6H12N4)2(NCS)3] · 2 H2O, a Trigonal Bipyramidal Cupric Complex

1981 ◽  
Vol 36 (5) ◽  
pp. 649-650 ◽  
Author(s):  
Joachim Pickardt
Keyword(s):  
Crystal Structure ◽  
Aqueous Solution ◽  
Structure Analysis ◽  
Title Compound ◽  
X Ray ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
Cupric Acetate

From an aqueous solution of cupric acetate containing an excess of KSCN and hexamethy- lenetetramine crystals of the title compound could be obtained. An X-ray structure analysis showed that the cuprate(II) anion has trigonal bipyramidal geometry. The three equatorial positions are occupied by NCS groups, the axial positions by the hexamethylenetetramine molecules

scholarly journals Di-μ-aqua-bis{diaqua[μ-4-({4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl}amino)benzenesulfonato]sodium(I)}

2012 ◽  
Vol 68 (6) ◽  
pp. m847-m848
Author(s):  
Mei Zhang ◽  
Fu-Yu Sun ◽  
Gui-Zhe Zhao ◽  
Ya-Qing Liu
Keyword(s):  
Hydrogen Bonds ◽  
Title Compound ◽  
Three Dimensional ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
Distorted Trigonal Bipyramidal

In the dinuclear title compound, [Na2(C13H15ClN5O5S)2(H2O)6] n , two Na+ cations, disposed about a centre of inversion, are linked by two bridging water molecules. The coordination geometry is based on an O5 donor set defined by four water molecules and a 4-aminobenzenesulfonate O atom in a distorted trigonal–bipyramidal geometry. In the crystal, significant O—H...O, O—H...N and N—H...O hydrogen bonds lead to the formation of a three-dimensional architecture.

(E)-4-[3-Ethoxy-4-(2-phenoxyethoxy)benzylideneamino]-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one

2006 ◽  
Vol 62 (7) ◽  
pp. o2963-o2964
Author(s):  
Wen-Jun Zhang ◽  
Zhong-Yu Duan ◽  
Xin Zhao
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Dihedral Angles ◽  
Ring Plane ◽  
Compound C ◽  
Phenyl Rings ◽  
Centrosymmetric Dimers

The title compound, C28H29N3O4, was prepared by the reaction of 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one and 3-ethoxy-4-(2-phenoxyethoxy)benzaldehyde. The vanillin group makes dihedral angles of 73.08 (8) and 66.54 (6)° with the planes of the two terminal phenyl rings, and an angle of 30.49 (6)° with the pyrazolone ring plane. The crystal structure is stabilized by intermolecular C—H...O hydrogen bonds that form centrosymmetric dimers.

81Br NQR and Crystal Structure of Ethylammonium Tribromomercurate(II), CH3CH2NH3HgBr3

1994 ◽  
Vol 49 (1-2) ◽  
pp. 202-208 ◽  
Author(s):  
Hiromitsu Terao ◽  
Tsutomu Okuda ◽  
Kichiro Koto ◽  
Shi-qi Dou ◽  
Alarich Weiss
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
High Temperatures ◽  
Title Compound ◽  
Room Temperature ◽  
Mercury Atom ◽  
Double Chain ◽  
Trigonal Bipyramidal ◽  
81Br Nqr ◽  
Increasing Temperature

Abstract The 81Br NQR triplet spectrum of (CH3CH2NH)3⊕(HgBr3)⊖ was measured in the range 77 K to near the m.p. (99~106°C) v1 decreases strongly with increasing temperature, exhibiting 136.784 MHz at 77 K and 128.129 MHz at 298 K. v2 decreases from 82.060 MHz at 77 K to 76.322 MHz at 298 K. v3 increases with temperature, showing v3 = 81.292 MHz at 77 K and 84.903 MHz at 298 K. Replacement of the ammonium hydrogens by deuterium produces a negative shift of v1 and positive ones of v2 and v3 at high temperatures. These shifts change with temperature from |~ 0| up to |~ 200| kHz. The crystal structure of the title compound was determined at room temperature: P 21/m, Z = 2, a = 1021.6(8) pm, b = 643.0(6) pm, c = 691.8(6) pm, β = 96.96 (4)°. The coordination of the mercury atom by the bromines is trigonal bipyramidal; by formation of bridges Hg··· Br··· Hg by one of the three bromines (Br(2)) of the planar HgBr⊖ ions a double chain of trigonal bipyramids is formed, running along the b-axis of the crystal. Br(1) and Br(3) are single bonded to Hg. The hydrogen bonds N -H···Br(1) and N -H ··· Br(3) (twice), connect the Hg-Br chains to planes lying parallel to the be plane at x = 0. The relations between the Br-NQR spectrum and the structure are discussed.

scholarly journals Crystal structure ofcatena-poly[[chlorido(4,4′-dimethyl-2,2′-bipyridine-κ2N,N′)copper(II)]-μ-chlorido]

2015 ◽  
Vol 71 (6) ◽  
pp. 624-627
Author(s):  
Rafaela Nita ◽  
Jeffrey R. Deschamps ◽  
Scott A. Trammell ◽  
D. Andrew Knight
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Title Compound ◽  
Trigonal Bipyramidal Geometry ◽  
Trigonal Bipyramidal ◽  
Bipyridine Ligand ◽  
Cl Atoms ◽  
Cl Atom ◽  
Distorted Trigonal Bipyramidal

The title compound, [CuCl2(C12H12N2)]n, was obtainedviaa DMSO-mediated dehydration of Cu(4,4′-dimethyl-2,2′-bipyridine)copper(II)·0.25H2O. The central CuIIatom is coordinated in a distorted trigonal–bipyramidal geometry by two N atoms of a chelating 4,4′-dimethyl-2,2′-bipyridine ligand [average Cu—N = 2.03 (3) Å] and three Cl atoms, one terminal with a short Cu—Cl bond of 2.2506 (10) Å, and two symmetry-equivalent and bridging bonds. The bridging Cl atom links the CuIIions into chains parallel to [001]viaone medium and one long Cu—Cl bond [2.3320 (10) and 2.5623 (9) Å]. The structure displays both inter- and intramolecular C—H...Cl hydrogen bonding.

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