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Crystalline Peroxosolvates: Nature of the Coformer, Hydrogen-Bonded Networks and Clusters, Intermolecular Interactions
Despite the technological importance of urea perhydrate (percarbamide) and sodium
percarbonate, and the growing technological attention to solid forms of peroxide, fewer than …
percarbonate, and the growing technological attention to solid forms of peroxide, fewer than …
Metal phosphonates incorporating metalloligands: assembly, structures and properties
SS Bao, MF Qin, LM Zheng - Chemical Communications, 2020 - pubs.rsc.org
Metal phosphonates are an important class of metal–organic hybrid materials that exhibit
versatile structures, intriguing functions and high water and thermal stability. Despite a large …
versatile structures, intriguing functions and high water and thermal stability. Despite a large …
Proton conductivity as a function of the metal center in porphyrinylphosphonate-based MOFs
The rational design of metal–organic frameworks (MOFs) is highly important for the
development of new proton conductors. Porphyrinylphosphonate-based MOFs, providing …
development of new proton conductors. Porphyrinylphosphonate-based MOFs, providing …
Highly Proton‐Conductive Zinc Metal‐Organic Framework Based On Nickel (II) Porphyrinylphosphonate
The design of new solid‐state proton‐conducting materials is a great challenge for chemistry
and materials science. Herein, a new anionic porphyrinylphosphonate‐based MOF (IPCE …
and materials science. Herein, a new anionic porphyrinylphosphonate‐based MOF (IPCE …
[HTML][HTML] Fast quantum approach for evaluating the energy of non-covalent interactions in molecular crystals: the case study of intermolecular h-bonds in crystalline …
AG Medvedev, AV Churakov, MA Navasardyan… - Molecules, 2022 - mdpi.com
Energy/enthalpy of intermolecular hydrogen bonds (H-bonds) in crystals have been
calculated in many papers. Most of the theoretical works used non-periodic models. Their …
calculated in many papers. Most of the theoretical works used non-periodic models. Their …
Interplay of π-stacking and inter-stacking interactions in two-component crystals of neutral closed-shell aromatic compounds: Periodic DFT study
SM Melikova, AP Voronin, J Panek, NE Frolov… - RSC …, 2020 - pubs.rsc.org
This paper bridges the gap between high-level ab initio computations of gas-phase models
of 1: 1 arene–arene complexes and calculations of the two-component (binary) organic …
of 1: 1 arene–arene complexes and calculations of the two-component (binary) organic …
On the molecular and supramolecular properties of N, N′-disubstituted iminoisoindolines: synthesis, spectroscopy, X-ray structure and Hirshfeld surface analyses …
Supramolecular studies of iminoisoindoline-derived compounds have been prompted by
their biological and photophysical properties. In this article, we report the synthesis …
their biological and photophysical properties. In this article, we report the synthesis …
An unexpected imidazole-induced porphyrinylphosphonate-based MOF-to-HOF structural transformation leading to the enhancement of proton conductivity
EA Zhigileva, YY Enakieva, VV Chernyshev… - Dalton …, 2024 - pubs.rsc.org
Post-synthetic modification of proton-conducting metal–organic frameworks (MOFs) by
loading small molecules capable of generating protons into pores is an efficient approach …
loading small molecules capable of generating protons into pores is an efficient approach …
Porphyrinylphosphonate‐Based Metal–Organic Framework: Tuning Proton Conductivity by Ligand Design
A novel metal–organic framework [Zn3 (Ni‐H2TPPP)(Ni‐H4TPPP)(Ni‐H5TPPP)⋅ 7 (CH3)
2NH2⋅ DMF⋅ 7 H2O](where Ni‐HxTPPP (x= 2, 4, 5) are partially deprotonated [5, 10, 15 …
2NH2⋅ DMF⋅ 7 H2O](where Ni‐HxTPPP (x= 2, 4, 5) are partially deprotonated [5, 10, 15 …
Electrochemical and spectroelectrochemical studies of diphosphorylated metalloporphyrins. Generation of a phlorin anion product
Two series of diphosphoryl-substituted porphyrins were synthesized and characterized by
electrochemistry and spectroelectrochemistry in nonaqueous media containing 0.1 M tetra-n …
electrochemistry and spectroelectrochemistry in nonaqueous media containing 0.1 M tetra-n …