Profiling Novel, Multifunctional Silane-Phosphonate Consolidants for the Mitigation of Gypsum Stone Deterioration via Concerted Autocondensation/Surface Complexation Processes [0.03%]
通过协同自聚/表面配位过程缓解石膏石破坏的新型多功能硅烷-膦酸固化剂的表征
Stefania Liakaki-Stavropoulou,Argyri Moschona,Ioannis E Grammatikakis et al.
Stefania Liakaki-Stavropoulou et al.
Mineral gypsum (selenite) stones have been used extensively by ancient Cretans in the Minoan Palace of Knossos (Crete, Greece), mostly for building and ornamental purposes. Exposure of mineral gypsum to environmental stresses (temperature f...
Confinement and Separation of Benzene from an Azeotropic Mixture Using a Chlorinated B←N Adduct [0.03%]
氯化B←N加合物从恒沸混合物中分離苯的研究
Isabella J Jupiter,Jesus Daniel Loya,Nicholas Lutz et al.
Isabella J Jupiter et al.
Separations of azeotropic mixtures are typically carried out using energy-demanding processes (e.g., distillation). Here, we report the capacity of a self-assembled chlorinated boronic ester-based adduct to confine acetonitrile and benzene ...
Evaluation of Individual and Crystal Population Dissolution Rates by Time-Resolved X-ray Microtomography [0.03%]
基于时间分辨X射线显微层析技术的单颗粒及颗粒群 dissolution 研究
Filip Hládek,David Zůza,Ondřej Navrátil et al.
Filip Hládek et al.
The intrinsic dissolution rate (IDR) is an important parameter in pharmaceutical science that measures the rate at which a pure crystalline active pharmaceutical ingredient dissolves in the absence of diffusion limitations. Traditional IDR ...
Tracking Prenucleation Molecular Clustering of Salicylamide in Organic Solvents [0.03%]
在有机溶剂中追踪水杨酰胺成核前分子聚集行为
Shubhangi Kakkar,Shayon Bhattacharya,Pierre-André Cazade et al.
Shubhangi Kakkar et al.
Crystal nucleation shapes the structure and product size distribution of solid-state pharmaceuticals and is seeded by early-stage molecular self-assemblies formed in host solution. Here, molecular clustering of salicylamide in ethyl acetate...
Juan D Velasquez,Noushin Keshtkar,Víctor Polo et al.
Juan D Velasquez et al.
We report herein, by means of structural and computational analyses, a comprehensive study of the capability of differently substituted haloalkenes to behave as electron density acceptors in noncovalent interactions. The nature of these int...
Continuous Invariant-Based Maps of the Cambridge Structural Database [0.03%]
基于不断发展的不变量的晶体结构数据库(CSD)分析图谱
Daniel E Widdowson,Vitaliy A Kurlin
Daniel E Widdowson
The Cambridge Structural Database (CSD) played a key role in the recently established crystal isometry principle (CRISP). The CRISP says that any real periodic crystal is uniquely determined as a rigid structure by the geometry of its atomi...
Perhalogenated Anilines as Bifunctional Donors of Hydrogen and Halogen Bonds in Cocrystals with Ditopic Nitrogen-Containing Acceptors [0.03%]
全卤代苯胺作为氢键和卤素受体的双功能供体与二位点含氮受体配晶中的相互作用
Nea Baus Topić,Sibananda G Dash,Edi Topić et al.
Nea Baus Topić et al.
In this study, we examine the experimental and theoretical capabilities of two perhalogenated anilines, 2,3,5,6-tetrafluoro-4-bromoaniline (btfa) and 2,3,5,6-tetrafluoro-4-iodoaniline (itfa) as hydrogen and halogen bond donors. A series of ...
Engineering Lipophilic Aggregation of Adapalene and Adamantane-Based Cocrystals via van der Waals Forces and Hydrogen Bonding [0.03%]
基于van der Waals力和氢键的维A酸及金刚烷衍生物共晶体系的脂ophilic自聚集作用工程学研究
Josephine Bicknell,Sidhaesh A Agarwal,Kyle J Petersen et al.
Josephine Bicknell et al.
Lipophilic aggregation using adamantanes is a widely exploited molecular property in medicinal and materials chemistry. Adamantanes are traditionally installed to molecular units via covalent bonds. However, the noncovalent installation of ...
Suppression of Disorder in Benzamide and Thiobenzamide Crystals by Fluorine Substitution [0.03%]
氟取代抑苯胺和硫代苯胺晶体中的无序现象
Alexander G Shtukenberg,Doris E Braun,Melissa Tan et al.
Alexander G Shtukenberg et al.
Disorder is a common feature of molecular crystals that complicates determination of structures and can potentially affect electric and mechanical properties. Suppression of disorder is observed in otherwise severely disordered benzamide an...
Impact of Inequivalent Wetting on the Face-Specific Dissolution Rates for Single Faceted-Crystals Predicted from Solid-State Binding Energies [0.03%]
基于固态结合能的单面晶体面向特异性溶解速率的模拟及仿真研究
Muhammad Najib,Robert B Hammond,Tariq Mahmud et al.
Muhammad Najib et al.
A methodology for the prediction of face-specific relative dissolution rates for single-faceted crystals accounting for inequivalent wetting by the solvent is presented. This method is an extended form of a recent binding energy model devel...