scholarly journals Synthesis of (N,N'-Bis(2-Hydroxyethyl)Ethane-1,2-Diamine)Malonatoplatinum(II) and X-Ray Crystal Structure of the Cis-R,S-Isomer

2000 ◽  
Vol 7 (6) ◽  
pp. 349-355 ◽  
Author(s):  
M. Galanski ◽  
M. Berger ◽  
B. K. Keppler
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Crystal Structure Analysis ◽  
Boat Conformation ◽  
Intermolecular Hydrogen Bonds ◽  
Ability To Act ◽  
Carrier Mediated Transport ◽  
Interesting Class ◽  
Hydroxy Groups ◽  
Single Crystal Structure Analysis

Hydroxyethyl substituted amineplatinum(II) and (IV) complexes are an interesting class of platinum based antitumour compounds due to their uncoordinated hydroxy groups. These hydroxy groups could play an important role in the mode of action of such complexes with respect to their ability to act as donor or acceptor for hydrogen bonds. Moreover, their chemistry in solution is of interest because it was found that there is the possibility of an intramolecular attack to form ethanolatoamine chelated species which are responsible for very stable monoadducts with 5'-GMP. Furthermore, there is the possibility of derivatisation at the OH site to form a new series of platinum compounds which may be used for a carrier mediated transport to tumour tissues. In this context a series of (N,N'-bis(2-hydroxyethyl)ethane-l,2-diamine)-platinum(II) complexes has been synthesised. During purification of one of the platinum based compounds, it was possible to isolate (SP-4-3)-R,S-(N,N'-bis(2-hydroxyethyl)ethane-l,2-diamine)malonatoplatinum(ll) and to resolve the structure by single crystal structure analysis. Intra- and intermolecular hydrogen bonds have been found which may explain the spontaneous crystallisation of the cis-R,S isomer and the stabilisation of the boat conformation of the malonatoplatinum(II) six-membered ring.

scholarly journals Crystal structure of 4,5,6,7,8,8-hexachloro-2-(3,4-dimethoxyphenethyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione [+solvent]

2019 ◽  
Vol 75 (5) ◽  
pp. 562-564
Author(s):  
R. Manohar ◽  
M. Harikrishna ◽  
S. Harikrishna Etti ◽  
C. Ramanathan ◽  
K. Gunasekaran
Keyword(s):  
Crystal Structure ◽  
Molecular Weight ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Membered Ring ◽  
Boat Conformation ◽  
Pyrrolidine Ring ◽  
Intermolecular Hydrogen Bonds ◽  
Acta Cryst ◽  
Compound C

In the title compound, C19H15Cl6NO4 [+solvent], the six-membered ring of the norbornene moiety adopts a boat conformation and the two five-membered rings have envelope conformations. The pyrrolidine ring makes a dihedral angle of 14.83 (12)° with the 3,4-dimethoxyphenyl ring, which are attached to each other by an extended N—CH2—CH2—Car bridge. In the crystal, the structure features C—H...O intermolecular hydrogen bonds, an offset π–π interaction [intercentroid distance = 3.564 (1) Å] and a C—Cl...π interaction. The contribution of some disordered solvent to the scattering was removed using the SQUEEZE routine [Spek (2015). Acta Cryst. C71, 9–18] of PLATON. The solvent contribution was not included in the reported molecular weight and density.

Copper(II) and cobalt(II) hydroxypyridinecarboxylates: Synthesis, crystal structures, spectral and magnetic properties

2008 ◽  
Vol 62 (5) ◽  
Author(s):  
Jozef Miklovič ◽  
Peter Segľa ◽  
Dušan Mikloš ◽  
Ján Titiš ◽  
Radovan Herchel ◽  
...  
Keyword(s):  
Hydrogen Bonds ◽  
Oxygen Atom ◽  
Crystal Structures ◽  
Magnetic Measurements ◽  
Crystal Structure Analysis ◽  
Amide Group ◽  
Carboxyl Group ◽  
Intermolecular Hydrogen Bonds ◽  
Single Crystal Structure Analysis

AbstractSynthesis and characterization of six copper(II) and cobalt(II) octahedral complexes [M(6-OHpic)2(H2O)2] (6-OHpic is 6-hydroxypicolinato), [M(2-OHnic)2(H2O)2] (2-OHnic is 2-hydroxynicotinato), [Cu(6-OHnic)2(H2O)2] (6-OHnic is 6-hydroxynicotinato) as well as [Co(H2O)6](6-OHnic)2 are reported. Their characterization was carried out using elemental analysis, infrared, and magnetic measurements. Based on IR spectra, N,O-coordination of 6-OHpic (via the oxygen atom of the carboxyl group and the nitrogen atom of the pyridine ring), O,O-asymmetrically chelating coordination of the carboxyl groups as well as ionic coordination of 6-OHnic and chelating O,O-coordination (through the oxygen atom of the carboxyl group and the oxygen atom of the amide group) of keto(amide) tautomer of 2-OHnic were supposed. Moreover, crystal structures of 2-OHnicH and the complex [Co(2-OHnic)2(H2O)2]) were determined by X-ray single crystal structure analysis. The system of hydrogen bonds predominantly stabilizes the keto(amide) tautomer of both 2-hydroxynicotinic acid and 2-OHnic anion in the cobalt(II) complex. Intermolecular hydrogen bonds (between the oxygen atom of the amide group and the hydrogen atom of the NH group) interconnect two neighbouring molecules of 2-OHnicH forming dimers. Cobalt(II) in complex [Co(2-OHnic)2(H2O)2] has nearly a regular compressed tetragonal bipyramidal arrangement.

Erdalkaliquadratate, VI [1] SrC4 O4 · 3H2O, Typ III / Alkaline-earth Squarates, VI [1] SrC4O4 ·3H2O, Type III

1988 ◽  
Vol 43 (1) ◽  
pp. 99-103 ◽  
Author(s):  
Christian Robl
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Alkaline Earth ◽  
Crystal Structure Analysis ◽  
Water Molecules ◽  
Type I ◽  
Intermolecular Hydrogen Bonds ◽  
X Ray ◽  
Type Iii ◽  
Close Relationship

AbstractSrC4O4 ·3 H2O, type III. was obtained in an aqueous silica gel besides crystals of SrC4O4-3 H20. type I. X-ray crystal structure analysis showed close relationship to BaC4O4-3H20. but no isotypism. Sr2+ is coord|inated by four water molecules and four oxygen atoms of the squarate dianion. The connection of Sr2+ with C4O42- leads to layers. The geometry of C4O42- is typical for delocalized π-systems. The Osquarate atoms are not equally bound to Sr2+. One Osquaralc atom (0(4)) is bound to two Sr2+, two (O(1). O(2)) are bound to one Sr2+, respectively, and the fourth Osquaratc atom (0(3)) shows no bonding contact to Sr2+. These differences are compensated for by intermolecular hydrogen bonds which involve O(3) three times, O( I) and O(2) once each, but not O(4).

Synthesis and single-crystal structure analysis of a new layered zinc phosphate

2005 ◽  
Vol 77 (10) ◽  
pp. 1707-1717 ◽  
Author(s):  
Natasa Zabukovec Logar ◽  
Nevenka Rajic ◽  
Djordje Stojakovic ◽  
Amalija Golobic ◽  
Venceslav Kaucic
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Single Crystal ◽  
Zinc Phosphate ◽  
Crystal Structure Analysis ◽  
Membered Ring ◽  
Crystal Data ◽  
Key Factor ◽  
Inorganic Layers ◽  
Single Crystal Structure Analysis

A new 2D zinc phosphate [H3NCH(CH3)CH2NH3]2+0.75[COOH(CH2)COOH]0.25(Zn3P3O11OH)2-* 0.5NH4+ consists of zinc phosphate layers, which are intercalated by diprotonated 1,2-diaminopropane, malonic acid, and NH4+ ions. The inorganic layers are composed of alternating ZnO4 and PO4 (PO3OH) tetrahedra that form 8-membered ring apertures. The intercalated species strongly interact with the zinc phosphate layers through hydrogen bonds, which is a key factor in stabilizing the structure. Crystal data: monoclinic, P21/a, a = 8.3457(1) Å, b = 16.8953(3) Å, c = 10.1817(2) Å, β = 95.3121(8)°, Z = 4, R = 0.0423.

A Crystallographic Study of Bis[S-benzyl-5-bromo-2-oxoindolin-3-ylidenemethanehydrazonthioate] Disulfide Solvated with Dimethylsulfoxide

2012 ◽  
Vol 9 (2) ◽  
pp. 87
Author(s):  
Mohd Abdul Fatah Abdul Manan ◽  
M. Ibrahim M. Tahir ◽  
Karen A. Crouse ◽  
Fiona N.-F. How ◽  
David J. Watkin
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Solvent Molecule ◽  
Site Occupancy ◽  
Unit Cell Parameters ◽  
Intermolecular Hydrogen Bonds ◽  
Triclinic Space Group ◽  
Cell Parameters ◽  
Crystallographic Study ◽  
Thiol Form

The crystal structure of the title compound has been determined. The compound crystallized in the triclinic space group P -1, Z = 2, V = 1839 .42( 18) A3 and unit cell parameters a= 11. 0460( 6) A, b = 13 .3180(7) A, c=13. 7321 (8) A, a = 80.659(3 )0, b = 69 .800(3 )0 and g = 77 .007 (2)0 with one disordered dimethylsulfoxide solvent molecule with the sulfur and oxygen atoms are distributed over two sites; S101/S102 [site occupancy factors: 0.6035/0.3965] and 0130/0131 [site occupancy factor 0.3965/0.6035]. The C22-S2 l and C 19-S20 bond distances of 1. 779(7) A and 1. 788(8) A indicate that both of the molecules are connected by the disulfide bond [S20-S21 2.055(2) A] in its thiol form. The crystal structure reveals that both of the 5-bromoisatin moieties are trans with respect to the [S21-S20 and CI 9-Nl 8] and [S20-S21 and C22-N23] bonds whereas the benzyl group from the dithiocarbazate are in the cis configuration with respect to [S21-S20 and C19-S44] and [S20-S21 and C22-S36] bonds. The crystal structure is further stabilized by intermolecular hydrogen bonds of N9-H35···O16 formed between the two molecules and N28-H281 ···O130, N28-H281 ···O131 and C4 l-H4 l l ···O 131 with the solvent molecule.

scholarly journals Organotin(IV) selenate derivatives – Crystal structure of [{(Ph3Sn)2SeO4} ⋅ CH3OH] n

2021 ◽  
Vol 44 (1) ◽  
pp. 213-217
Author(s):  
Waly Diallo ◽  
Hélène Cattey ◽  
Laurent Plasseraud
Keyword(s):  
Crystal Structure ◽  
Solid State ◽  
Hydrogen Bonds ◽  
Point Of View ◽  
Intermolecular Hydrogen Bonds

Abstract Crystallization of [(Ph3Sn)2SeO4] ⋅ 1.5H2O in methanol leads to the formation of [{(Ph3Sn)2SeO4} ⋅ CH3OH] n (1) which constitutes a new specimen of organotin(IV) selenate derivatives. In the solid state, complex 1 is arranged in polymeric zig-zag chains, composed of alternating Ph3Sn and SeO4 groups. In addition, pendant Ph3Sn ⋅ CH3OH moieties are branched along chains according to a syndiotactic organization and via Sn-O-Se connections. From a supramolecular point of view, intermolecular hydrogen bonds established between the selenate groups (uncoordinated oxygen) and the hydroxyl functions (CH3OH) of the pendant groups link the chains together.

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].

Stimuli-Responsive Luminescent Supramolecular Assemblies and Co-assemblies by Orthogonal Dipole-Dipole Interaction and Halogen Bonding

2021 ◽  
Author(s):  
Akshoy Jamadar ◽  
Ajeet Kumar Singh ◽  
Lisa Roy ◽  
Anindita Das
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Structure Analysis ◽  
Halogen Bonding ◽  
Dipole Interaction ◽  
Crystal Structure Analysis ◽  
Supramolecular Assemblies ◽  
Single Crystal Structure ◽  
Stimuli Responsive ◽  
Single Crystal Structure Analysis

This article reports π-chromophore assemblies from three structurally related dipolar naphthalene monoimide (NMI) luminogens (M1, M2 and M3) by underexplored orthogonal dipole-dipole interaction and halogen bonding. Single crystal structure analysis...

scholarly journals Crystal structure oftrans-N,N′-bis(3,5-di-tert-butyl-2-hydroxyphenyl)oxamide methanol monosolvate

2016 ◽  
Vol 72 (7) ◽  
pp. 918-921
Author(s):  
Miguel-Ángel Velázquez-Carmona ◽  
Sylvain Bernès ◽  
Francisco Javier Ríos-Merino ◽  
Yasmi Reyes Ortega
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Hydroxy Group ◽  
Molecular Conformation ◽  
Methanol Molecule ◽  
Molecular Symmetry ◽  
Methyl Group ◽  
Supramolecular Motifs ◽  
Butyl Group ◽  
Hydroxy Groups

The here crystallized oxamide was previously characterized as an unsolvated species [Jímenez-Pérezet al.(2000).J. Organomet. Chem.614–615, 283–293], and is now reported with methanol as a solvent of crystallization, C30H44N2O4·CH3OH, in a different space group. The introduction of the solvent influences neither the molecular symmetry of the oxamide, which remains centrosymmetric, nor the molecular conformation. However, the unsolvated molecule crystallized as an ordered system, while many parts of the solvated crystal are disordered. The hydroxy group in the oxamide is disordered over two chemically equivalent positions, with occupancies 0.696 (4):0.304 (4); onetert-butyl group is disordered by rotation about the C—C bond, and was modelled with three sites for each methyl group, each one with occupancy 1/3. Finally, the methanol solvent, which lies on a twofold axis, is disordered by symmetry. The disorder affecting hydroxy groups and the solvent of crystallization allows the formation of numerous supramolecular motifs using four hydrogen bonds, with N—H and O—H groups as donors and the oxamide and methanol molecule as acceptors.

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