C28H36CuF6N8P
收藏DataCite Commons2023-09-22 更新2025-04-09 收录
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https://www.chemotion-repository.net/inchikey/UVLHGRADYISRGZ-UHFFFAOYSA-N.3
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This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367]. The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]: InChI descriptor[cheminf_000113]: InChI=1S/2C14H18N4.Cu.F6P/c2*1-17(2)14(18(3)4)16-12-9-5-7-11-8-6-10-15-13(11)12;;1-7(2,3,4,5)6/h2*5-10H,1-4H3;;/q;;+1;-1, and canonical SMILES descriptor[cheminf_000007]: F[P-](F)(F)(F)(F)F.CN(C(=Nc1cccc2c1nccc2)N(C)C)C.CN(C(=Nc1cccc2c1nccc2)N(C)C)C.[Cu+], and by the IUPAC name[cheminf_000107]: . The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]: The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-36076 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]: Melting point descriptor[CHEMINF_000256]: Boiling point descriptor[CHEMINF_000257]: Refractive index descriptor[CHEMINF_000253]: The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]: CHMO:0000025 | cyclic voltammetry (CV) CHMO:0000025 | cyclic voltammetry (CV) The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: Used ontologies: CHEBI - Chemical Entities of Biological Interest CHEMINF - chemical information ontology (information entities about chemical entities) CHMO - Chemical Methods Ontology OBI - Ontology for Biomedical Investigations
这是一个与分子[CHEBI_25367]相关联的物理化学实体[CHEBI_24431]。该分子[CHEBI_25367]可通过以下结构描述符[cheminf_000085]进行描述:InChI描述符[cheminf_000113]:InChI=1S/2C14H18N4.Cu.F6P/c2*1-17(2)14(18(3)4)16-12-9-5-7-11-8-6-10-15-13(11)12;;1-7(2,3,4,5)6/h2*5-10H,1-4H3;;/q;;+1;-1,以及规范SMILES描述符[cheminf_000007]:F[P-](F)(F)(F)(F)F.CN(C(=Nc1cccc2c1nccc2)N(C)C)C.CN(C(=Nc1cccc2c1nccc2)N(C)C)C.[Cu+],还可通过IUPAC名称[cheminf_000107]描述:。该物理化学实体[CHEBI_24431]含有一种组分溶剂[CHEBI_46787],其通过规范SMILES描述符[cheminf_000007]描述:该物理化学实体[CHEBI_24431]在研究数据仓库chemotion(www.chemotion-repository.net,https://doi.org/10.25504/FAIRsharing.iagXcR)中注册的样本ID为:CRS-36076。该物理化学实体[CHEBI_24431]可通过以下物理描述符[CHEMINF_000025]描述:熔点描述符[CHEMINF_000256]:沸点描述符[CHEMINF_000257]:折射率描述符[CHEMINF_000253]:。该物理化学实体[CHEBI_24431]还可通过以下实验分析[OBI:0000070][CHMO:0001133]进一步描述:CHMO:0000025 | 循环伏安法(CV)CHMO:0000025 | 循环伏安法(CV)。该物理化学实体[CHEBI_24431]已存入卡尔斯鲁厄理工学院(KIT)的分子档案库,样本ID为:所用本体:CHEBI - 生物相关化学实体;CHEMINF - 化学信息本体(关于化学实体的信息实体);CHMO - 化学方法本体;OBI - 生物医学研究本体。
提供机构:
chemotion-repository
创建时间:
2023-09-22



