[Cu(I){N(QuMe)(PhDMEG)2}]PF6

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/C32H36N8.Cu.F6P/c1-23-17-18-24-11-10-16-29(30(24)33-23)40(27-14-8-6-12-25(27)34-31-36(2)19-20-37(31)3)28-15-9-7-13-26(28)35-32-38(4)21-22-39(32)5;;1-7(2,3,4,5)6/h6-18H,19-22H2,1-5H3;;/q;+1;-1, and canonical SMILES descriptor[cheminf_000007]: F[P-](F)(F)(F)(F)F.Cc1ccc2c(n1)c(ccc2)N(c1ccccc1N=C1N(C)CCN1C)c1ccccc1N=C1N(C)CCN1C.[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-46490 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:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR) CHMO:0000470 | mass spectrometry (MS) CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR) CHMO:0000630 | infrared absorption spectroscopy (IR) 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本实体为与某分子[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]进行表征： InChI描述符[cheminf_000113]：InChI=1S/C32H36N8.Cu.F6P/c1-23-17-18-24-11-10-16-29(30(24)33-23)40(27-14-8-6-12-25(27)34-31-36(2)19-20-37(31)3)28-15-9-7-13-26(28)35-32-38(4)21-22-39(32)5;;1-7(2,3,4,5)6/h6-18H,19-22H2,1-5H3;;/q;+1;-1；标准SMILES描述符[cheminf_000007]：F[P-](F)(F)(F)(F)F.Cc1ccc2c(n1)c(ccc2)N(c1ccccc1N=C1N(C)CCN1C)c1ccccc1N=C1N(C)CCN1C.[Cu+]；IUPAC命名[cheminf_000107]：无。 该物理化学实体[CHEBI_24431]包含组分溶剂[CHEBI_46787]，其可通过标准SMILES描述符[cheminf_000007]表征： 该物理化学实体[CHEBI_24431]在研究数据仓储chemotion（www.chemotion-repository.net，https://doi.org/10.25504/FAIRsharing.iagXcR）中注册的样本编号为：CRS-46490。 该物理化学实体[CHEBI_24431]可通过以下物理描述符[CHEMINF_000025]进行表征： 熔点描述符[CHEMINF_000256]：无 沸点描述符[CHEMINF_000257]：无 折射率描述符[CHEMINF_000253]：无 该物理化学实体[CHEBI_24431]还可通过以下分析测试方法[OBI:0000070][CHMO:0001133]进行表征： CHMO:0000593 | 氢核磁共振波谱法（1H NMR） CHMO:0000470 | 质谱法（MS） CHMO:0000595 | 碳-13核磁共振波谱法（13C NMR） CHMO:0000630 | 红外吸收光谱法（IR） 该物理化学实体[CHEBI_24431]已存入卡尔斯鲁厄理工学院（Karlsruhe Institute of Technology, KIT）的分子档案库，对应样本编号为： 所用本体： CHEBI：生物感兴趣的化学实体（Chemical Entities of Biological Interest） CHEMINF：化学信息本体（即针对化学实体的信息实体） CHMO：化学方法本体（Chemical Methods Ontology） OBI：生物医学调查本体（Ontology for Biomedical Investigations）