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Achiral Molecule (achiral + molecule)
Selected AbstractsAsymmetry Induction by Cooperative Intermolecular Hydrogen Bonds in Surface-Anchored Layers of Achiral Molecules,CHEMPHYSCHEM, Issue 10 2006Alexandre Dmitriev Dr. Abstract The mesoscale induction of two-dimensional supramolecular chirality (formation of 2D organic domains with a single handedness) was achieved by self-assembly of 1,2,4-benzenetricarboxylic (trimellitic) acid on a Cu(100) surface at elevated temperatures. The combination of spectroscopic [X-ray photoelectron spectroscopy (XPS) and near-edge X-ray absorption fine structure (NEXAFS)], real-space-probe [scanning tunneling microscopy (STM)], and computational [density functional theory (DFT)] methods allows a comprehensive characterization of the obtained organic adlayers, where details of molecular adsorption geometry, intermolecular coupling, and surface chemical bonding are elucidated. The trimellitic acid species, comprising three functional carboxylic groups, form distinct stable mirror-symmetric hydrogen-bonded domains. The chiral ordering is associated with conformational restriction in the domains: molecules anchor to the substrate with an ortho carboxylate group, providing two para carboxylic acid moieties for collective lateral interweaving through H bonding, which induces a specific tilt of the molecular plane. The ease of molecular symmetry switching in domain formation makes homochiral-signature propagation solely limited by the terrace width. The molecular layer modifies the morphology of the underlying copper substrate and induces ,m-sized strictly homochiral terraces. [source] A list of organic kryptoracematesACTA CRYSTALLOGRAPHICA SECTION B, Issue 1 2010László Fábián A list of 181 organic kryptoracemates has been compiled. This class of crystallographic oddities is made up of racemic compounds (i.e. pairs of resolvable enantiomers) that happen to crystallize in Sohnke space groups (i.e. groups that include only proper symmetry operations). Most (151) of the 181 structures could have crystallized as ordered structures in non-Sohnke groups. The remaining 30 structures do not fully meet this criterion but would have been classified as kryptoracemates by previous authors. Examples were found and checked with the aid of available software for searching the Cambridge Structural Database, for generating and comparing InChI strings, and for validating crystal structures. The pairs of enantiomers in the true kryptoracemates usually have very similar conformations; often the match is near-perfect. There is a pseudosymmetric relationship of the enantiomers in about 60% of the kryptoracemate structures, but the deviations from inversion or glide symmetry are usually quite easy to spot. Kryptoracemates were found to account for 0.1% of all organic structures containing either a racemic compound, a meso molecule, or some other achiral molecule. The centroid of a pair of enantiomers is more likely (99.9% versus 99% probability) to be located on an inversion center than is the centroid of a potentially centrosymmetric molecule. [source] A VCD robust mode analysis of induced chirality: The case of pulegone in chloroform,CHIRALITY, Issue 1E 2009Valentin Paul Nicu Abstract Vibrational modes in an achiral molecule may acquire rotational strength by complexation to a chiral molecule, as happens for achiral solvent molecules complexed to a chiral solute. We investigate this transfer of chirality in vibrational circular dichroism for the pulegone molecule in CDCl3 solvent from the point of view of the robustness concept introduced recently. It turns out that the transfer of chirality yields nonrobust modes, which means that, although they are observed in vibrational circular dichroism (VCD) experiments, the sign of these modes cannot be predicted reliably with standard (Density Functional Theory) VCD calculations. This limits the usefulness of the induced chirality phenomenon for obtaining information on the intermolecular interactions that give rise to it. Chirality 21:E287,E297, 2009. © 2010 Wiley-Liss, Inc. [source] One-Pot Synthesis of Functional Helicoidal Hybrid Organic,Inorganic Nanofibers with Periodically Organized MesoporosityADVANCED FUNCTIONAL MATERIALS, Issue 18 2009Frédéric Rambaud Abstract The one-pot synthesis and properties of multifunctional hybrid mesoporous organosilica fibers with helical shapes are described. These hybrid mesoporous fibers are prepared without chiral elements and functionalized with a large variety of organic R functions (R,=,alkylthiols, phenylsulfonates, alkylphosphonates, dansyl, aminopropyl, fluoroalkyl, etc.). The resulting nanomaterials are thoroughly characterized by a variety of techniques. The use of a synergetic combination of achiral molecules as co-directing structuring agents, a surfactant, and an organofunctional silica precursor R-Si(OR)3 allows, via carefully tuning of the main synthesis parameters and processing conditions, to control the shape, which is the anisotropic factor, of the hybrid nanofibers. The functionalization of the hybrid materials with fluorescent molecules (dansyl) and gold nanoparticles opens possibilities for sensor and catalytic applications, respectively. Moreover, these hybrid nanofibers can be easily transferred in organic solvents or in a "green" solvent such as water to make stable colloidal dispersions. This tunable functionality of nanofibers also allows their transferability into a variety of polymeric hosts (PVDF, PVBu, and PVP) allowing the formation of functional homogeneous nanocomposite hybrid membranes. [source] Dipyridinium dichromate: an achiral compound forming chiral crystalsACTA CRYSTALLOGRAPHICA SECTION C, Issue 5 2009Anders Lennartson The title compound, (C5H6N)2[Cr2O7], crystallizes in one of the Sohncke space groups, viz.P212121. Crystallization of dipyridinium dichromate is thus an example of spontaneous formation of a chiral crystal structure from achiral molecules. The dichromate anion adopts a virtually eclipsed achiral conformation, and the crystal structure is held together primarily by N,H...O and C,H...O interactions. The possibility of using dipyridinium dichromate as a reagent in enantioselective synthesis is discussed. [source] | ||||||||||