Influence of Molecular Conformation on the Solid State Packing of 1,2-Diglycerides Study of 1,2-Dipalmitin and Some Structural Analogs by Electron Diffraction, X-Ray Diffraction, and Infrared Spectroscopy

1978 ◽  
Vol 33 (1-2) ◽  
pp. 39-49 ◽  
Author(s):  
Douglas L. Dorset ◽  
Walter A. Pangborn ◽  
Anthony J. Hancock ◽  
Iris S. Lee

Abstract Diffraction studies on natural 1,2-dipalmitin and on analogs, including those based on the configurational isomers of cyclopentane-1,2,3-triol reveal that the 1,2-diglycerides crystallize from solvent with chain methylene packing identical to the monoclinic form of even-chain alkanes. The chains probably are folded back in “hairpin” fashion as found in phospholipid crystal structures. Acyl shifts are observed to occur in the crystalline solid state at room temperature to give the 1,3-diglyceride. Analogs based on the above-mentioned cyclitols show that isomers with adjacent chains trans to the ring (possibly extended chain packing) or with chains cis to the ring (“hair­ pin”) crystallize readily. Both possibly extended chain configurational isomers have the α-form as well as β′-forms and a β-polymorph. The hairpin isomers each give a β′-polymorph but only the all-cts isomer gives an α-form.

2016 ◽  
Vol 10 (3) ◽  
pp. 183-188 ◽  
Author(s):  
Mohamed Afqir ◽  
Amina Tachafine ◽  
Didier Fasquelle ◽  
Mohamed Elaatmani ◽  
Jean-Claude Carru ◽  
...  

SrBi1.8Ce0.2Nb2O9 (SBCN) and SrBi1.8Ce0.2Ta2O9 (SBCT) powders were prepared via solid-state reaction method. X-ray diffraction analysis reveals that the SBCN and SBCT powders have the single phase orthorhom-bic Aurivillius structure at room temperature. The contribution of Raman scattering and FTIR spectroscopy of these samples were relatively smooth and resemble each other. The calcined powders were uniaxially pressed and sintered at 1250?C for 8 h to obtaine dense ceramics. Dielectric constant, loss tangent and AC conductivity of the sintered Ce-doped SrBi2Nb2O9 and SrBi2Ta2O9 ceramics were measured by LCR meter. The Ce-doped SBN (SBCN) ceramics have a higher Curie temperature (TC) and dielectric constant at TC (380?C and ?? ~3510) compared to the Ce-doped SBT (SBCT) ceramics (330?C and ?? ~115) when measured at 100Hz. However, the Ce-doped SBT (SBCT) ceramics have lower conductivity and dielectric loss.


1978 ◽  
Vol 56 (14) ◽  
pp. 1874-1880 ◽  
Author(s):  
Philippe Joubert ◽  
Roland Bougon ◽  
Bernard Gaudreau

The oxypentafluorouranates(VI) MUOF5, where M = NH4, K, Rb, Cs, have been synthetized from reaction of UOF4 with the ammonium or corresponding alkali metal fluoride in liquid SO2. According to X-ray diffraction, Raman and infrared spectroscopy, and from an isomorphism with the corresponding hexafluorouranates(V) MUF6, two different environments around the uranium atom are observed. In CsUOF5 the five fluorine atoms and the oxygen around the uranium result in a pseudo-octahedral surrounding whereas for the other complexes (M = NH4, K, Rb) each uranium is surrounded by eight light atoms forming a dodecahedron. In this structure the dodecahedra are linked together by fluorine atoms to form infinite chains. The UOF5− ion has been characterized by vibrational spectroscopy in the solid state. The proposed assignment, which was made with the assumption of a C4v symmetry of the UOF5− ion, was confirmed by a force constant calculation. From these data and contrary to the values reported for comparable oxypentafluoroanions, the axial fluorine is found to be less ionic than the equatorial ones.


1978 ◽  
Vol 31 (6) ◽  
pp. 1195 ◽  
Author(s):  
BN Figgis ◽  
BW Skelton ◽  
AH White

The room-temperature (295 K) crystal structures of potassium ferricyanide, K3[Fe(CN)6], have been determined for the simplest monoclinic (a reinvestigation) and orthorhombic polytypes by single- crystal X-ray diffraction. The monoclinic form is P21/c, a 7.047(3), b 10.400(3), c 8.384(3) Ǻ, β 107.29(3)°, Z 2. The iron atoms lie on special positions with symmetry 1. In the orthorhombic form, Pnca, a 13.422(6), b 10.396(4), 8.381(4) Ǻ, Z4, the iron atoms now lie on special positions with symmetry 2 (parallel to c). Residuals are 0.036 and 0.048 for 1232 and 855 'observed' reflections respectively.


2014 ◽  
Vol 70 (11) ◽  
pp. 1025-1028
Author(s):  
Hong Shen

The title CdIIcoordination polymer, [Cd(C10H8O4)(C12H12N6)0.5(H2O)]n, has been obtained by the hydrothermal method and studied by single-crystal X-ray diffraction, elemental analysis, thermogravimetric analysis, IR spectroscopy and fluorescence spectroscopy. The compound forms a novel three-dimensional framework with 3,8-connected three-dimensional binodal {4.52}2{42.510.612.7.83} topology. An investigation of its photoluminescence properties shows that the compound exhibits a strong fluorescence emission in the solid state at room temperature.


2012 ◽  
Vol 548 ◽  
pp. 77-81
Author(s):  
Jia Hua Ma ◽  
Cheng Jia Tan ◽  
Xia Deng ◽  
Chao Xin

Preparation techniques of chitosan from Catharsius molossus L. processing discards were studied by orthogonal design. Preparation techniques were as follows:demineralizing: soaked for 30 min at 80 °C with 1.3 mol•L-1 HCl, then kept for 12 h under room temperature. Deproteinization and delipidation: treated for 6 h at 90 °C with 4 mol•L-1 NaOH. Decolorizing: soaked at room temperature with 3% KMnO4, then treated with 2% oxalic acid at 70 °C. Deacetylation: treated for 6 h at 110 °Cwith 14 mol•L-1 NaOH. Properties of chitosan were characterized by Fourier transform infrared spectroscopy(FTIR), X-ray diffraction (XRD), etc. It proved the technique was stable and feasible. The result also preliminarily showed that chitosan from Catharsius molossus L. was better than shrimp’s. It will be widely applicated in biomedical and other industrial areas with such exiciting properties.


2017 ◽  
Vol 126 (1B) ◽  
pp. 147
Author(s):  
Nguyen Thi Thuy

<p><strong>Abstract: </strong>LaFeO<sub>3</sub> system with doped Ti, Co, Cu was manufactured by solid state reaction method, it was sintered at 1250<sup>0</sup>C and 1290<sup>0</sup>C in 10 hours with a heating rate of 3<sup>0</sup>C/min. Using X-ray diffraction and Scanning Electron Microscope (SEM) to examine the structure, it reveals that samples are single-phase and orthogonal-perovskite structure describing by the Pnma space group, the unit cell volume of the samples increases when Ti, Co, Cu are doped to replace ion Fe<sup>+3</sup>. The size of particle increase while raising the temperature of sintering. Measuring the resistance which depends on temperature between the room temperature and 1000K, it can be seen that when doping Co, Cu with the nominal component La(Fe<sub>0,2</sub>Co<sub>0,2</sub>Ti<sub>0,6</sub>)O<sub>3</sub> and La(Fe<sub>0,4</sub>Cu<sub>0,1</sub>Ti<sub>0,5</sub>)O<sub>3 </sub>, the conductivity of samples increases respectively. Especially, the conductivity of Cu doped sample is higher than two other samples, and reach the highest conductivity at about 900<sup>0</sup>C, Seebeck coefficient S of La(Fe<sub>0.6</sub>Ti<sub>0.4</sub>)O<sub>3</sub> can be change from positive to negative at the temperature of around 700<sup>0</sup>C.</p>


2007 ◽  
Vol 22 (1) ◽  
pp. 59-63 ◽  
Author(s):  
Min Li ◽  
Wenxia Yuan ◽  
Jingfang Wang ◽  
Cong Gu ◽  
Huaizhou Zhao

Trigonal rare-earth dioxymonocyanamides Ln2O2CN2 (Ln=Dy, Ho, Er, Tm, Yb) were synthesized by the modified solid-state metathesis (SSM) method, in which Ln2O3 and melamine C3N6H6 were mixed and heated at 850 °C in vacuumed silica ampoules. Possible chemical reaction pathways are proposed. X-ray diffraction (XRD) patterns of Ln2O2CN2 were refined using the Rietveld method. Compounds Ln2O2CN2 crystallize in the trigonal system with space group P3m1, Z=1, and cell parameters of a and c varying from 3.7267(1) to 3.6407(1) Å and from 8.1848(3) to 8.1152(3) Å, respectively, as Ln atoms change from Dy to Yb. These compounds have stacking structures of Ln2O22+ and CN22− layers, similar to those of previously reported compounds Ln2O2CN2 (Ln=Ce, Pr, Nd, Sm, Eu, Gd). The presence of CN22− ions has been confirmed by infrared spectroscopy, with two characteristic peaks in the vicinity of 651 and 2075 cm−1.


2014 ◽  
Vol 70 (12) ◽  
pp. 1138-1142 ◽  
Author(s):  
Le Li ◽  
Jian-Qing Tao

A twofold interpenetrating three-dimensional CdIIcoordination framework, [Cd(C8H3NO6)(C14H14N4)]n, has been prepared and characterized by IR spectroscopy, elemental analysis, thermal analysis and single-crystal X-ray diffraction. The asymmetric unit consists of a divalent CdIIatom, one 1,3-bis(2-methyl-1H-imidazol-1-yl)benzene (1,3-BMIB) ligand and one fully deprotonated 5-nitrobenzene-1,3-dicarboxylate (NO2-BDC2−) ligand. The coordination sphere of the CdIIatom consists of five O-donor atoms from three different NO2-BDC2−ligands and two imidazole N-donor atoms from two different 1,3-BMIB ligands, forming a distorted {CdN2O5} pentagonal bipyramid. The NO2-BDC ligand links three CdIIatomsviaa μ1-η1:η1chelating mode and a μ2-η2:η1bridging mode. The title compound is a twofold interpenetrating 3,5-connected network with the {42.65.83}{42.6} topology. In addition, the compound exhibits fluorescence emissions in the solid state at room temperature.


2021 ◽  
Vol 5 (1) ◽  
pp. 341-346
Author(s):  
Jun Zhang ◽  
Haoke Zhang ◽  
Junkai Liu ◽  
Jacky Wing Yip Lam ◽  
Ben Zhong Tang

Changes of molecular conformation in the solid state play a vital role in many advanced technologies.


Sign in / Sign up

Export Citation Format

Share Document