均裂能BDE数据集（1907-2024）

均裂能BDE数据集覆盖1907-2024年的数据，主要包括化合物唯一标识符，有机化合物ID，断裂位置，BDE值，溶液，方法，文献ID等信息。从公开发表的科技文献中收集整理得到。利用web of science检索引擎，以键能相关的主题关键词，加逻辑关系，从各类同行评审的科技期刊中系统检索1900年以来的键能相关的文献。通过仔细阅读每一篇与公开发表的键能相关的科技文献，手工逐条收集并整理其中包含的键能相关信息，然后由专门的键能专家进行严格审核后，将其录入数据库。The Homolytic Bond Dissociation Energy (BDE) dataset covers data from 1907 to 2024, mainly including information such as compound unique identifiers, organic compound IDs, cleavage sites, BDE values, solvents, experimental methods, and literature IDs. This dataset is compiled from publicly published scientific literature. We conducted systematic retrieval of bond energy-related literature published since 1900 across various peer-reviewed scientific journals using the Web of Science search engine, with thematic keywords related to bond energy and logical operators. Relevant bond energy information from each published scientific literature related to bond energy was manually collected and organized item by item through careful reading, then strictly reviewed by specialized bond energy experts before being incorporated into the database.

搜集汇总

背景与挑战

背景概述

该数据集是一个覆盖1907年至2024年、专注于有机化学领域均裂能（BDE）研究的专业数据库，包含化合物标识符、BDE值、溶液和方法等关键字段。数据来源于公开发表的科技文献，通过系统检索和专家手工审核确保质量，适用于化学键能相关的研究分析。