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Hirshfeld surfaces表面分析

WebbHirshfeld surface s and their associated two-dimensional fingerprint plots were used to analyze the intermolecular interactions in the crystal structure. ヒルシュフェルト表面と … WebbFinally, Hirshfeld surfaces and fingerprint plots are employed for a comparison of the two independent molecules in the asymmetric unit of (1) and also, for a comparison of (6), …

Hirshfeld Surface - an overview ScienceDirect Topics

Webb10 jan. 2016 · Hirshfeld 既是人名，也是德国的地名，汉语音译为“赫希菲尔德”，不过从后面 surface analysis 判断，这是指“（德国）赫希菲尔德地表分析”。 抢首赞 评论 分享 … http://www.yydbzz.com/article/2024/1004-0781/1004-0781-37-1-12.shtml toshiba u8000vs ptt https://catherinerosetherapies.com

Single crystal, Hirshfeld surface and theoretical analysis of ... - PLOS

Webb15 sep. 2024 · Intermolecular interactions have proved to play an important role in properties of SMMs such as quantum tunneling of magnetization (QTM), and they also … WebbHirshfeld surface analysis and surface properties were calculated by the Tonto computational chemistry package (backend of CrystalExplorer[1]), which is based on … WebbHirshfeld Surface Analysis和Fingerprint Plots是进行 晶体内相互作用分析 的重要手段和方法。 其实这些分析很容易去做，直接用CrystalExplorer软件点点鼠标就够了，并不像其 … toshiba ultrabook i5 drivers

hirshfeld surface 什么意思 - 百度知道

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Hirshfeld surfaces表面分析

Hirshfeld Atom Refinementの概要と実例について - 日本郵便

Webb25 dec. 2012 · Hirshfeld Surface Analysis 是用来做什么的 已有6人参与 在一些晶体文章中偶尔会见到Hirshfeld Surface Analysis 和Hirshfeld 2D Fingerprint plot（如配图）， … http://www.set-science.com/manage/uploads/ISAS2024-Winter_0039/SETSCI_ISAS2024-Winter_0039_00132.pdf

Hirshfeld surfaces表面分析

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Webb11 dec. 2024 · Hirshfeld Surface analysis consists of d norm and two-dimensional finger print plots were used to identify intermolecular interactions in the compound I. The d norm surface (–0.1391 to 1.3516) is shown in Fig. 3. The leading interaction between nitrogen and oxygen (O–H⋅⋅⋅N) can be recognized in this structure by the red color surface. WebbHirshfeld surfaces analysis [49] was performed to quantify and visualize the closed intermolecular atomic contacts in the crystal structure of (C 9 H 14 N) 2 [SnCl 6]. …

Webb#crystalexplorertutorial #crystalexplorer #crystalexplorertraining #hirshfeldsurfacesCrystal Explorer - step by step procedures for Hirshfeld surfaces, inter... Webb31 mars 2024 · A new antibacterial complex C 4 H 15 CuN 5 O 7 S, which is derived from the non-insulin-dependent diabetes mellitus drug metformin hydrochloride (MH) and cupric sulfate pentahydrate, is prepared and characterized. The complex shows that a three-dimensional supramolecular structure and the intermolecular interactions are analyzed …

http://muchong.com/html/201205/7667478.html Webb29 apr. 2024 · Crystal structures of six benzaldehyde derivatives (1–6) have been determined and their supramolecular networks were established by an X-ray crystallographic study.The study has shown that the compounds are linked by various intermolecular interactions such as weak C–H⋯O hydrogen bonding, and C–H⋯π, π–π …

WebbHirshfeld表面との分子間相互作用の定量分析へ向けて Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces 出版者サイト 複写サービス 高度な …

Webb14 dec. 1998 · Striking new images of molecular crystals are afforded by isosurface rendering of smooth, nonoverlapping molecular surfaces arising from a novel … toshiba ultrabook i5Webb30 juni 2024 · Hirshfeld Surface Analysis and Interactions Energy Calculations of Metal (II) 4-Cyanobenzoate with Nicotinamide / N,N'-Diethylnicotinamide Complexes Article Full-text available Jan 2024 Füreya... toshiba vt130g9u2025WebbCrystalexplorer 3.1 software is used for the Hirshfeld surface analysis. Some cif file is not open with 17.5 version of this software. Then, We need 3.1 a version of this software. toshiba vt130g9u4055