Crystallography – Organic

Synthesis and Characterization of New Formylpyrazolones and Schiff bases

6 days ago by Julio Belmar and others at

Universidad de Concepcion

A Metal-“Organic Cage” Framework for the Removal of Polycyclic Aromatic Hydrocarbons from Water

29 August 2024 by Bhaswati Paul and others

Large-scale parameter estimation for Crystal Structure Prediction. Part 1: Dataset, Methodology, and Implementation

21 August 2024 by David Bowskill and others at

Imperial College London

Theoretical and Computational Chemistry, Organic Chemistry

From Beam Damage to Massive Reaction Amplification Under the Electron Microscope: An Ionization-Induced Chain Reaction in Crystals of a Dewar Benzene

19 August 2024 by Krzysztof Konieczny and others at

UC Los Angeles

Organic Chemistry, Nanoscience

Polymorphism and flexibility of six-porphyrin nanorings in the solid state

16 August 2024 by Harry Anderson and Wojciech Stawski at

University of Oxford

Organic Chemistry, Physical Organic Chemistry

Assessing the applicability of Bayesian inference for merging small molecule microED data

16 August 2024 by Huanghao Mai and others at

Caltech

Organic Chemistry, Crystallography – Organic

A Robust Crystal Structure Prediction Method to Support Small Molecule Drug Development with Large Scale Validation and Prospective Studies

12 August 2024 by Dong Zhou and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Structural diversity in 1D hydrogen-bonded chains assembled through bis(triazole) self–association

6 August 2024 by Jordan Smith and Nicholas White at

Organic Chemistry, Supramolecular Chemistry

Cation⋅⋅⋅anion and anion⋅⋅⋅anion interactions compete in hydrogen-bonded frameworks prepared using amidinium⋅⋅⋅phosphonate hydrogen bonding

1 August 2024 by Phonlakrit Muang-Non and Nicholas White at

Revisiting a natural wine salt: Calcium 2R,3R-tartrate tetrahydrate

1 August 2024 by Alvaro Polo and others

Organic Chemistry, Crystallography – Organic

Pinpointing the Onset of Water Harvesting in Reticular Frameworks from Structure

31 July 2024 by Ha Nguyen and others at

UC Berkeley

Theoretical and Computational Chemistry, Organic Chemistry

Using Chemical Substitution to Engineer Photomechanical Cinnamalmalononitrile Crystals

22 July 2024 by Thomas Gately and others at

UC Riverside

Organic Chemistry, Organic Synthesis and Reactions

MOCOFs: Crystalline porous frameworks based on double extension of metal–organic and covalent organic linkages

19 July 2024 by Kenichi Endo and others at

University of Stuttgart

A double-walled noncovalent carbon nanotube by columnar packing of nanotube fragments

18 July 2024 by Daiki Imoto and others at

Nagoya Univ.

Organic Chemistry, Supramolecular Chemistry

Light-Triggered Rolling and Unrolling of Molecular Crystal Microsheets

9 July 2024 by Pranay Ghate and others at

UC Riverside

Organic Chemistry, Photochemistry

Continuous and reversible transformation of the polymorphs of an MGAT2 inhibitor (S-309309) from the anhydrate to the hydrate in response to relative humidity

20 June 2024 by Hiroshi Ueda and others

Organic Chemistry, Analytical Chemistry

Near-quantitative Removal of Oxalate and Terephthalate from Water by Precipitation with a Rigid Bis-amidinium Compound

18 June 2024 by Rosemary Goodwin and others at

Topology-Directed Synthesis of Helical Phosphoniums with High Diradical Character and Polar-Dependent Electron Transfer

7 June 2024 by Bo Yang and others at

Nanjing University

Organic Chemistry, Organic Compounds and Functional Groups

A three-component hydrogen bonded framework

13 May 2024 by Phonlakrit Muang-Non and others at

University of New South Wales

Direct Air Capture of CO2 via Reactive Crystallization

23 April 2024 by Diāna Stamberga and others at

Oak Ridge National Laboratory

Organic Chemistry, Crystallography – Organic

Crystallographic and spectroscopic studies on persistent triarylpropargyl cations

15 April 2024 by Takuya Shimajiri and others at

Hokkaido University

Gram-Scale Total Synthesis of Carbazomycins A–D

12 April 2024 by Yuxuan Feng and others at

Kobe University

Development of a Novel Solid State Organic Fluorophore: Excited-State Aromatization-Induced Structural Planarization

3 April 2024 by Domenic Pace and others at

University of Pittsburgh

Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation

27 March 2024 by Caitlin Shields and others at

University of Liverpool

Theoretical and Computational Chemistry, Organic Chemistry

Heterocycles as Supramolecular Handles for Crystal Engineering: A Case Study with 7-(diethylamino)coumarin Derivatives

18 March 2024 by Geraldyne Castro and others at

Universidad Nacional Autónoma de México

Open Frameworks Formed from Iodoalkyne∙∙∙Halide Halogen Bonds

29 February 2024 by Jordan Smith and Nicholas White at

Quantifying Near-Symmetric Molecular Distortion Using Symmetry-Coordinate Structural Decomposition

29 February 2024 by Christopher Kingsbury and Mathias Senge

Theoretical and Computational Chemistry, Organic Chemistry

A Practical Synthesis and X-Ray Crystal Structure of (E)-4-(1-naphthylvinyl)pyridine and Related Compounds

28 February 2024 by James G. D. Moffat and others at

Carleton University