4-Formyl-2-（2H-benzotriazol-2-yl）-phenol： an ESIPT chromophore

In the present work, excited state intramolecular proton transfer （ESIPT） emission properties of a new benzotriazole derivative 4-formyl-2-（2H-benzotriazol-2-yl）- phenol （C1） were studied. 4-Formyl-2-（2H-benzotriazol-2- yl）-methoxy-benzene （C2）, 4-formyl-2-（2H-benzotriazol-2- yl）-phenyl acetate （C3） and 4-methyl-2-（2H-benzotriazol- 2-yl）-phenol （C4） were used as the reference molecules. ^1H NMR chemical shift of hydroxy group in C1 was located at more down field than that of C4 or p-hydroxy-benzaldehyde （C5）, respectively. C1 showed two absorption bands in the range of 260-400 nm zones in various solvents, while C2 and C3 exhibited single absorption band. The equal molar mixtures of C2/C5 or C3/C5 showed single absorption band. C2 and C3 displayed single fluorescence emission band in various solvents, while C1 exhibited dual emission bands in some strong polar solvents. Furthermore, the second emission band in these strong polar solvents showed the large Stokes shift. The results show that the second emission band of C1 was produced by ESIPT. C2 and C3 could not undergo ESIPT due to no hydroxy group. The geometry optimization calculation of enol and keto forms in the ground and excited states of C1 provided tough theoretical evidences of ESIPT.     

Synthesis, structure of iron(III)-containing imidazolium salts and their catalytic activity in the alkylation of aryl Grignard reagents

A series of iron(III)-containing imidazolium salts of the general formula [DRim][FeX₄] (R = 2,6-diisopropylphenyl, IPr, X = Cl, 1; R = IPr, X = Br, 2; R = tertbutyl, ^t Bu, X = Cl, 3; R = isopropyl, ⁱ Pr, X = Cl, 4; R = benzyl, Bn, X = Cl, 5; R = Bn, X = Br, 6) have been prepared in high yields via reactions of anhydrous ferric halides with equivalent of the corresponding N,N-dihydrocarby-limidazolium halides, where 2–6 are novel ones. All of the complexes were characterized by elemental analysis, Raman spectroscopy, electrospray ionization mass spectroscopy, and X-ray crystallography for 1 and 2. All of them were non-hygroscopic and air-stable, with four of them existing as solids (1–4) and two as liquids (5 and 6) at room temperature. A preliminary catalytic study on the coupling of 4-tolylmagnesium bromide with cyclohexyl bromide revealed that 1 and 3 possessed the highest activity. In comparison, 2, 4 and 5 exhibited moderate activity and the least active complex was 6.     

Synthesis and self-assembly of two 1,3-alternate thiacalix[4]arenes derivatives bearing amide groups

Two 1,3-alternate thiacalix[4]arene derivatives bearing amide groups, 1,3-alternate p-tert-butylthiacalix[4]arene tetraamide (4), and 1,3-alternate p-H-thiacalix[4]arene tetraamide (6) were prepared, and their crystal structures were determined by single-crystal X-ray diffraction method. The steric hindrances posed by tert-butyl groups play an important part in the synthesis and the self-assembly of the two compounds. Compound 6 was synthesized from the corresponding ester, which was obtained by the reaction of acid chloride with ammonia. In the crystal structure, compound 4 presents a highly symmetric molecular structure, while for compound 6, because of absence of tert-butyl groups, it presents a more flexible molecular structure.     

Synthesis, structure, optoelectronic properties of novel zinc Schiff-base complexes

Two novel zinc Schiff-base complexes, bis-(N-(2-hydroxybenzidene)-p-aminodimethylaniline)zinc(II) (2) and bis-(N-(2-hydroxy-1-naphthidene)-p-aminodimethylaniline)zinc(II) (4) were designed and synthesized. Both the complexes exhibit good solubility in organic solvents and excellent thermal stabilities. A single crystal of 2 was grown and its crystalline structure was determined from X-ray diffraction data. Analysis of the electronic structures of both the zinc complexes calculated by density functional theory reveals a localization of orbital. The UV-Vis absorption and photoluminescence profiles of 4 in thin film are similar to those of 2, but the emission for 4 is red-shifted compared to 2. Three-layered devices with a configuration of ITO/NPB/2/Alq 3 /LiF/Al and ITO/NPB/4/Alq 3 /LiF/Al show a yellow and red emission, respectively.     

New terpenoids from the roots of Jatropha curcas

Two new sesquiterpenoids,(1S,2R)-dihydroxycycloax-4(15)-ene(1),14-dehydroxyl daucucarotol(2),and one new rhamnofalane diterpenoid,2-hydroxy-3-dehydroxycaniojane(3),together with two known compounds,curcusone D(4) and curcusone C(5),were isolated from the roots of Jatropha curcas.The chemical structures of these compounds were established by chemical methods and extensive 1D-and 2D-NMR spectroscopic data analyses.     

Synthesis and characterization of carbon-bridged bis(phenolate) lanthanum alkoxides and their catalytic behavior for the polymerization of L-lactide

Four lanthanum alkoxides stabilized by a carbon-bridged bis(phenolate) ligand were synthesized and their catalytic behavior for the ring-opening polymerization of L-lactide was explored. Reactions of [(MBMP)LaCp(THF) 2 ] (MBMP 2 = 2,2′-methylene-bis(6-tert-butyl-4-methyl phenoxo)) with HOCH 2 Ph, HOCH 2 CF 3 , HOCH(CH 3 ) 2 , and HOCH 2 CH 2 N(CH 3 ) 2 , respectively, in a 1:1 molar ratio in THF gave the dimeric lanthanum alkoxo complexes [(MBMP)Ln(μ-OR)(THF) 2 ] 2 (OR = OCH 2 Ph(1), OCH 2 CF 3 (2), OCH(CH 3 ) 2 (3), OCH 2 CH 2 N(CH 3 ) 2 (4)]. These complexes were well characterized, and the definitive molecular structure of complex 1 was determined. It was found that complexes 1 to 4 are efficient initiators for the ring-opening polymerization of L-lactide. The structure of the alkoxo groups has a significant effect on the catalytic behavior, and complex 2 can initiate L-lactide polymerization in a controlled manner.     

An operator on ascent sequences

We solve two problems about ascent sequences: how to get the ascent sequence of the reflection of A with respect to its antidiagonal for a matrix A∈ Intn and its ascent sequences, and how to determine the ascent sequence of A+B for k×k matrices A∈ Intn and B∈ Intm. We give the other definition of ascent sequence and get M-sequence. For the first question, we define M-sequence of A and rewrite the ascent sequences as another form.We build the bijection between M-sequences and ascent sequences and prove that our bijection is well-defined. For the second question, we define an operation on M-sequences. On the basis of the operation and the bijections, we get the ascent sequences of the sum of two matrices.     

Development of Fe(III)-containing ether-functionalized imidazolium ionic liquids for aryl Grignard cross-coupling of alkyl halides

A series of Fe(Ⅲ)-containing imidazolium-based ionic liquids containing ether substituents,including[C3OMim][FeCl4](1,[C3OMim]=1-(2-methoxyethyl)-3-methylimidazolium),[C3OiPim][FeCl4](2,[C3OiPim]=1-isopropyl-3-(2-methoxyethyl)imidazolium),[C3OBim][FeCl4](3,[C3OBim]=1-butyl-3-(2-methoxyethyl)imidazolium),[(C3O)2im][FeCl4](4,[(C3O)2im]=1,3-bis(2-methoxyethyl)imidazolium),[C3OMim][FeBr4](5)and[(C3O)2im][FeBr4](6),were prepared and characterized by elemental analysis,Raman spectroscopy and electrospray ionization mass spectrometry.The catalytic performances of 1–6 and related Fe(III)-based catalysts in the cross-coupling of aryl Grignard reagents with alkyl halides bearing-hydrogens were studied,revealing that mono(ether)functionality improves the catalytic activity and that bis(ether)functionality improves the reusability.After simply decanting the product contained in the ethereal layer,complex 4,which containing bis(ether)-functionalized imidazolium cation,could be successfully recycled seven times.     

Ionic iron（III） complex of aryloxo-linked bis（imidazolium） cations： efficient and recyclable catalyst for aryl Grignard cross-coupling of alkyl chlorides

A novel phenol-linked bis（imidazolium） salt, H3LCl2 （L = O-4-C（CH3）3-C6H2-2,6-di[CH2{C（NCHCH- NAr）}]2, Ar = 2,6-diisopropylphenyl, 1）, was designed and used to prepare an ionic iron（III） complex [H2L][FeCl4] （2）. Complex 2 was a highly efficient catalyst for aryl Grignard cross-coupling of alkyl chlorides bearing β-hydrogens. Furthermore, complex 2 was reusable and could be reused in at least eight times without significant loss in catalytic activity.     

Synthesis, spectra, structure and quantum chemistry study on two novel oxovanadium complexes with hydrotris （pyrazolyl） borate ligands

Vanadium is a trace element in lives. Though vana- dium was investigated in life science from 1876, the importance of vanadium in lives was not recognized until 1971[1,2]. Since bromoperoxidase and nitrogenase were found and proved that vanadium plays an …     

Identification of Markovian open system dynamics for qubit systems

We discuss the problem of identification of the dynamical generators for open two-level quantum systems in a Markovian environment.Based on Bloch sphere representation,the identification problem is converted to the estimation of a 3-dimensional real process matrix A and an inhomogeneous term c.The parameter identifiability and sufficient conditions for completely identification of A and c are obtained.Further discussion shows that the obtained sufficient conditions are not always necessary.The approach can be generalized to finite-level open quantum systems in an arbitary Markovian environment.     

Synthesis of novel chiral bisoxazoline ligands with a spiro[4,4]-1,6-nonadiene skeleton

A new type of chiral bisoxazoline ligands 1 based on spiro[4,4]-1,6-nonadiene backbone was easily prepared in six steps from racemic spiro[4,4]-nonane-1,6-dione, with the Pd-catalyzed coupling of the enol triflates with CO and amino alcohols as the key steps for the construction of the oxazoline moiety. The structure of the ligand (R,S,S)-1b was unambiguously established by X-ray crystallographic analysis. The chiral Cu(II) complex generated in situ from the combination of spiro bisoxazoline ligand (S,S,S)- 1c and Cu(OTf)₂ was effective in the catalysis of asymmetric chlorination of the β-ketoester, methyl 1-oxo-2,3-dihydro-1H- in-dene-2-carboxylate, affording the corresponding chlorinated derivative in 99% yield with 17% ee.     

The semileptonic decays of B/B s meson in the perturbative QCD approach: a short review

In this short review, we present the current status about the theoretical and experimental studies for some important semileptonic decays of \(B/B_s\) mesons. We firstly gave a brief introduction for the experimental measurements for \(B/B_s \rightarrow P (l^+l^-, l^-\bar{\nu }_l, \nu \bar{\nu })\) decays, the BaBar’s \(R(D)\) and \(R(D^*)\) anomaly, the \(P_5^\prime \) deviation for \(B^0 \rightarrow K^{*0} \mu ^+ \mu ^-\) decay. We then made a careful discussion about the evaluations for the relevant form factors in the light-cone QCD sum rule, the heavy quark effective theory, and the perturbative QCD factorization approach. By using the form factors calculated in the perturbative (pQCD) approach, we then calculate and show the pQCD predictions for the decay rates of many semileptonic decays of \(B/B_s\) mesons. We also made careful phenomenological analysis for these pQCD predictions and found, in general, the following points: (a) For all the considered \(B/B_s\) semileptonic decays, the next-to-leading order pQCD predictions for their decay rates agree well with the data and those from other different theoretical methods; (b) For \(R(D)\) and \(R(D^*)\) , the pQCD predictions agree very well with the data, the BaBar’s anomaly of \(R(D^{(*)})\) are therefore explained successfully in the standard model by employing the pQCD approach; and (c) We defined several new ratios \(R_D^{l,\tau }\) and \(R_{D_s}^{l,\tau }\) , they may be more sensitive to the QCD dynamics which controls the \(B/B_s \rightarrow (D^{(*)},D_s^{(*)} )\) transitions than the old ratios, we therefore strongly suggest LHCb and the forthcoming Super- \(B\) experiments to measure these new ratios.     

A new second-order Mehrotra-type predictor-corrector algorithm for SDO

In Zhang's recent works,a second-order Mehrotra-type predictor-corrector algorithm for linear optimization was extended to semidefinite optimization and derived that the algorithm for semidefinite optimization had O(n~(3/2)log(X~0)~T·S~0/ε) iteration complexity based on the NT direction as Newton search direction. In this paper, we extend the second-order Mehrotra-type predictor-corrector algorithm for linear optimization to semidefinite optimization and discuss the polynomial convergence of the algorithm by modifying the corrector direction and new iterates. It is proved that the iteration complexity is reduced to O(n~(3/2)log(X~0)~T·S~0/ε), which coincides with the currently best iteration bound of Mehrotra-type predictor-corrector algorithm for semidefinite optimization.     

Form factors for B meson weak decays in QCD light cone sum rules with a chiral current correlator

We report some applications of QCD light cone sum rules (LCSR) to \(B\) meson weak decays. Special emphasis is on estimates of the form factors for \(B\) decays into a pseudoscalar ( \(P\) )/vector ( \(V\) ) meson, with a certain chiral current correlator. The main new ingredient, as compared with the case of the standard correlators, is that in the operator product expansion calculations, the contributions due to the twist-3 distribution amplitudes of the related light mesons, which are less known and would bring a larger uncertainty to the calculations with the standard correlators, cancel out fully in the \(B\rightarrow P\) case and do out partially in the \(B\rightarrow V\) one. An important observation, which is similar to that in soft collinear effective theory, is made in twist-3 approximation: whereas only one independent form factor is needed for parameterizing the hadronic matrix elements for a \(B\rightarrow P\) transition induced by all the relevant heavy-light quark currents, there exist two independent form factors under the condition of neglecting the terms suppressed by a factor of \(m_V^2\) , for the \(B\rightarrow V\) transition. Therefore, the improved LCSR approach could be of stronger predictive power for the weak form factors. Also, this approach is employed to understand the \(B\rightarrow D\) transitions by introducing a leading twist-2 DA for an energetic \(D\) meson, combined with some of other QCD-based approaches. A detailed QCD next-to-leading order calculation of the \(B\rightarrow \pi \) form factors is presented for an illustrative purpose, and the sum rule results are used to extract the Cabibbo–Kobayashi–Maskawa matrix element \(|V_{ub}|\) from the latest BaBar data.     

Higgs precision measurements and flavor physics: a supersymmetric example

Rare decays in flavor physics often suffer from Helicity suppress and Loop suppress. Helicity flip is a direct consequence of chiral \(U(3)\) symmetry breaking and electroweak symmetry breaking. The identical feature is also shared by the mass generation of SM fermions. In this review, we use the Minimal Supersymmetric Standard Model (MSSM) as an example to illustrate an explicit connection between bottom Yukawa coupling and rare decay process of \(b\rightarrow s\gamma \) . We take a symmetry approach to study the common symmetry breaking in supersymmetric correction to bottom quark mass generation and \(b\rightarrow s\gamma \) . We show that Large Peccei-Quinn symmetry breaking effect and \(R\) -symmetry breaking effect required by \(b\rightarrow s\gamma \) inevitably lead to significant reduction of bottom Yukawa \({y}_{b}\) . To compromise the reduction in \(b\bar{b}\) , a new decay is also needed to keep the Higgs total width as the SM value.     

The loop effects on the chargino decays ～χ±1→～χ0 1ff ′in the MSSM

The lighter chargino three body decays ～χ±1→～χ0 1ff ′ via the W^± boson and the charged Higgs boson H^± were studied in the R-parity conserved Minimal Supersymmetric Standard Model （MSSM）. We treat ～χ±1 decays as production and decay of W^± and H^± i.e.,～χ±1→～χ01W^±（H^±） → χ0 1ff ′. Both higgsino- like and wino-like ～χ±1 decays were well investigated. These decays are calculated at 1-loop level and the loop corrections are found to be less than three percent. The signal of the charged Higgs H^± production from ～χ±1 decays is discussed. It will offer important information about the chargino and neutralino sector, as well as the charged Higgs sector in the MSSM.     

The two-body hadronic decays of B c meson in the perturbative QCD approach: a short review

Along with the running of Large Hadron Collider (LHC) located at CERN in November 2009, a large number of data samples of \(B_c\) meson have been collected and some hadronic \(B_c\) decay modes have been measured by the LHC experiments. In view of the special and important roles of \(B_c\) meson decays playing in the heavy flavor sector, we here give a short review on the status of two body hadronic decays \(B_c \rightarrow M_1 M_2\) at both experimental and theoretical aspects. For the theoretical progresses, specifically, we will show lots of theoretical studies on two body hadronic \(B_c\) decays involving pseudoscalar, vector, scalar, axial-vector, even tensor meson(s) in the final states by employing the perturbative QCD (pQCD) factorization approach. We will present a general analysis about the two-body hadronic decays of the heavy \(B_c\) meson and also provide some expectations for the future developments.     

The nonleptonic two body B decays involving a light tensor meson in final states

The nonleptonic two body \(B_{u,d,s,c}\) decays involving a light tensor meson in final states are studied in the perturbative QCD approach based on \(k_{\mathrm{T}}\) factorization. The decay modes with a tensor meson emitted, are prohibited in naive factorization, since the emission diagram with a tensor meson produced from vacuum is vanished. While contributions from the so-called hard scattering emission diagrams and annihilation type diagrams are important and calculable in the perturbative QCD approach. The branching ratios of most decays are in the range of \(10^{-4}\) – \(10^{-8}\) , which are bigger by 1 or 2 orders of magnitude than the predictions given by the naive factorization, but consistent with the predictions from the QCD factorization and the recent experimental measurements. We also give the predictions for the direct \(CP\) asymmetries, some of which are large enough for the future experiments to measure. We also find that, even with a small mixing angle, the mixing between \(f_2\) and \(f_2^{\prime }\) can bring remarkable changes to both branching ratios and the direct \(CP\) asymmetries for some decays involving \(f_2^{(\prime )}\) mesons. For decays with a vector meson and a tensor meson in final states, we predict a large percentage of transverse polarization contributions due to the contributions of the orbital angular momentum of the tensor mesons.