bis(2,9-dimethyl-1,10-phenanthroline) copper (I) perchlorate | 41574-54-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 英文名称: bis(2,9-dimethyl-1,10-phenanthroline) copper (I) perchlorate
• 英文别名: bis(2,9-dimethyl-1,10-phenanthroline) copper(I) perchlorate；bis(2,9-dimethyl-1,10-phenanthroline)copper(I) perchlorate；bis(2,9-dimethyl-1,10-phenathroline) copper(I) perchlorate；copper(I) perchlorate 2,9-dimethyl-1,10-phenantroline；{Cu(2,9-dimethyl-phen)2}ClO4；[Cu(2,9-dimethyl-1,10-phenanthroline)2][ClO4]；copper(1+);2,9-dimethyl-1,10-phenanthroline;perchlorate
• CAS: 41574-54-3
• 化学式: C₂₈H₂₄CuN₄*ClO₄
• 分子量: 579.522
• InChiKey: ZBSBWETXVZHELN-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为反应物：
  描述：

  bis(2,9-dimethyl-1,10-phenanthroline) copper (I) perchlorate 、 Mn(N,N'-dioxo-2,2'-bipyridine)3(3+) 以 乙腈 为溶剂， 生成 Cu(2,9-dimethyl-1,10-phenanthroline)2(2+)
  参考文献：
  名称：

  门控行为的解释：乙腈中双（2,9-二甲基-1,10-菲咯啉）铜（I / II）的氧化和还原反应的动力学研究。

  摘要：

  二茂铁（Fe（Cp）（2）=双（环戊二烯基）铁（II））还原Cu（dmp）（2）（2+）（dmp = 2,9-二甲基-1,10-菲咯啉），十甲基二茂铁（Fe（PMCp）（2）=双（五甲基环戊二烯基）铁（II））和Co（bpy）（3）（2+）（bpy = 2,2'-联吡啶）和Cu（dmp）的氧化反应Ni（tacn）（2）（3+）（tacn = 1,4,7-三氮杂环壬烷）和Mn（bpyO（2））（3）（3+）（bpyO（2）=为了解释涉及铜（II）和-（I）物种的门控行为，在乙腈中研究了N，N'-dioxo-2,2'-联吡啶）。结果表明，Cu（dmp）（2）（2 + / +）对通过Ni（tacn）（2）的氧化反应估计出的电子自交换速率常数。 ）（3+）（5.9 x 10（2）kg mol（-）（1）s（-）（1））和Mn（bpyO（2））（3）（3+）（2。9 x 10（4）kg mol（-）

  DOI：

  10.1021/ic9810687
• 作为产物：
  描述：

  [Cu(2,9-dimethyl-1,10-phenanthroline)₂](ClO₄)₂ 在 hypophosphorous acid or hydroxylammonium-salt 作用下， 以 not given 为溶剂， 生成 bis(2,9-dimethyl-1,10-phenanthroline) copper (I) perchlorate
  参考文献：
  名称：

  Visible Absorption Characteristics of the Bis-(2,9-dimethy-1,10-phenanthroline)- and Bis-(4,4´,6,6´-tetramethyl-2,2´-bipyridine)-Copper(I) Ions.

  摘要：

  DOI：

  10.1021/ac60206a042

文献信息

• Solvation Behaviour of some Copper (I), Silver (I) and Tetraalkylammonium Salts in Actonitrile + Adiponitrile Mixtures
  作者：Dip Singh Gill、Dilbag Rana、Rahul Gupta

  DOI：10.1524/zpch.2008.5357

  日期：2008.7.1

  Solvation behaviour of some copper (I), silver (I) and tetrabutylammonium salts has been investigated in binary mixtures of acetonitrile and adiponitrile containing 100, 90, 80, 70, 60 and 50 mol % AN at 298 K using molar conductance and viscosity measurements. The conductance data have been analyzed by using the Shedlovsky method to calculate limiting molar conductance (Λ_o) of the electrolytes. The solvated radii for various ions indicate that tetrabutylammonium (Bu₄N⁺) and tetraphenylborate (BPh₄ ^–) are not solvated in all AN+ADN mixtures. The anions are poorly solvated but Cu⁺ and Ag⁺ are highly solvated in AN+ADN mixtures. The extent of solvation of Cu⁺ is greater then that of Ag⁺. The solvation of these both ions increases in ADN rich region of the mixtures. The viscosity data have been analyzed by using the Jones-Dole equation to calculate viscosity B-coefficients of electrolytes. The ionic B_± coefficients for individual ions have been evaluated. The results show that anions are weakly solvated in whole composition range of AN + ADN mixtures. The B₊ coefficients for Cu⁺ and Ag⁺ increase with increase in ADN composition i.e. these are better solvated in ADN rich region of binary mixtures. The viscosity results are in good agreement with the results obtained from the conductance studies.

  本研究使用摩尔电导率和粘度测量，研究了在含有100, 90, 80, 70, 60和50摩尔％的乙腈和己二腈的二元混合物中，一些铜（I）、银（I）和四丁基铵盐的溶解行为。使用Shedlovsky方法分析电导数据，计算电解质的极限摩尔电导率（Λo）。各种离子的溶剂化半径表明，四丁基铵（Bu4N+）和四苯基硼酸盐（BPh4-）在所有AN + ADN混合物中均未被溶剂化。阴离子溶剂化较差，但Cu+和Ag+在AN + ADN混合物中高度溶剂化。Cu+的溶剂化程度大于Ag+。这两种离子的溶剂化在混合物的ADN丰富区域增加。使用Jones-Dole方程分析粘度数据，计算电解质的粘度B系数。评估了各个离子的离子B±系数。结果表明，阴离子在AN + ADN混合物的整个组成范围内均溶解较弱。Cu+和Ag+的B+系数随着ADN组分的增加而增加，即在ADN丰富的二元混合物中更易溶解。粘度结果与电导研究结果相符。

• Transport properties of copper(<scp>I</scp>) perchlorates in mixed solvents. Part 2.—Conductance and viscosity measurements of bis(2,9-dimethyl-1, 10-phenanthroline)copper(<scp>I</scp>) perchlorate in binary solvent mixtures containing acetonitrile
  作者：Dip Singh Gill、Kanh Singh Arora、Balbir Singh、Mandeep Singh Bakshi、Mohinder Singh Chauhan

  DOI：10.1039/ft9918701159

  日期：——

  80, 70, 60, 50, 40, 30, 20, 10 and 0 mol% acetonitrile. The conductance and viscosity data have been analysed by the Shedlovsky and Jones–Dole equations, respectively. The limiting ion conductances of the [Cu(DMphen)2]+ cation in various solvent systems have been evaluated by combining Λo values of [Cu(DMphen)2]ClO4 with the accurate λClO4–O values obtained from our previous studies. The viscosity B

  电导和双的粘度（2,9-二甲基1，10-菲咯啉）铜（我），高氯酸（[铜（DMphen）2 ] CLO 4）已在浓度范围内（0.6-6）×10已经测量-4 mol DM –3和（6-250）×10 – mol DM –3分别在25°C下的乙腈-水（AN-H 2 O），乙腈-甲醇（AN-MeOH），乙腈-丙酮（AN –AC）和乙腈– N，N-二甲基甲酰胺（AN-DMF）混合物，其中包含100、90、80、70、60、50、40、30、20、10和0摩尔％的乙腈。电导率和粘度数据分别通过Shedlovsky和Jones-Dole方程进行了分析。所述的极限离子电导[铜（DMphen）2 ] +中各种溶剂体系的阳离子已通过组合Λ评价ö的值[铜（DMphen）2 ] CLO 4与准确λ CLO 4 - ö从我们之前获得的值学习。已评估了盐在各种溶剂体系中的粘度B系数，并将其分为[Cu（DMphen）2]
• Structural forms in complexes of 2,9-dimethyl-1,10-phenanthroline with simple salts of copper(I) and other univalent ‘closed shell’ species
  作者：Siti Mutrofin、Eric J. Chan、Peter C. Healy、Alessandro Marinelli、Jean Ngoune、Claudio Pettinari、Riccardo Pettinari、Neil Somers、Brian W. Skelton、Allan H. White

  DOI：10.1016/j.ica.2007.11.009

  日期：2008.6

  characterizations of a series of Cu(I)-phenanthroline complexes are reported. A single crystal X-ray structure determination is recorded for CuNO3:dmp:MeCN (1:1:1), ‘dmp’ = 2,9-dimethyl-1,10-phenanthroline, showing it to be isomorphous with its previously studied tetrafluoroborate, perchlorate and hexafluorophosphate, and silver(I) perchlorate counterparts, the metal atom lying in a trigonal planar

  摘要报道了一系列Cu（I）-菲咯啉配合物的合成，光谱学和结构表征。记录CuNO3：dmp：MeCN（1：1：1）的单晶X射线结构测定，'dmp'= 2,9-二甲基-1,10-菲咯啉，表明它与先前研究的四氟硼酸盐同构，高氯酸根和六氟磷酸根以及高氯酸银（I）对应物，金属原子位于三角形平面[（N∧N）Cu（NCMe）]配位环境中，阴离子未配位。还报告了[Cu（dmp）2] +阳离子的多种盐的结构（重新）测定：高氯酸盐，与许多其他盐同构，不仅包括铜（I），而且还包括锂（I） ，还有未溶剂化的硝酸盐和氯化物的溶剂化形式。
• Isentropic Compressibility Studies of Some Salts in Acetonitrile + <i>N,N</i>-dimethylacetamide Mixtures at 298 K
  作者：Dilbag Singh Rana、Dip Singh Gill、Mohinder Singh Chauhan、Rahul Gupta

  DOI：10.1524/zpch.2011.5533

  日期：2011.4.1

  Ultrasonic velocities and densities of some copper(I) and silver(I) salts have been measured in the concentration range 0.002–0.28 mol kg⁻¹ in binary mixtures of acetonitrile (AN) + N,N-dimethylacetamide (DMA) containing 100, 80, 60, 40, 20 and 0 mol % AN at 298 K. The isentropic compressibility (K _s) and apparent molal isentropic compressibility in various solvent systems have been calculated by using ultrasonic velocity (u) and partial molal volume (V _φ ) respectively. Limiting apparent molal isentropic compressibilities (K _s,φ ⁰) for various salts have been evaluated from vs. m ^1/2 plots and split into the contributions of individual ions (K _s,φ ⁰)_±. The (K _s,φ ⁰)_± values for copper(I) and silver(I) ions are found to be negative over the entire composition range which indicate strong solvation of these complex ions. The (K _s,φ ⁰)_± values for these ions increase with increase in DMA composition shows that the extent of solvation increases with increase in DMA composition.

  在含有100、80、60、40、20和0 mol％乙腈（AN）+ N，N-二甲基乙酰胺（DMA）的二元混合物中，在浓度范围0.002-0.28 mol kg-1下，测量了一些铜（I）和银（I）盐的超声速度和密度，温度为298 K。通过使用超声速度（u）和部分摩尔体积（Vφ）分别计算了各种溶剂体系中的等熵压缩性（Ks）和表观摩尔等熵压缩性。从vs.m1/2图中评估了各种盐的极限表观摩尔等熵压缩性（Ks,φ0），并将其分为各个离子的贡献（Ks,φ0）±。发现铜（I）和银（I）离子的（Ks,φ0）±值在整个组成范围内均为负值，表明这些复杂离子的溶剂化很强。这些离子的（Ks,φ0）±值随DMA组成的增加而增加，表明溶剂化程度随DMA组成的增加而增加。

• Liquid-assisted mechanochemical synthesis, crystallographic, Hirshfeld surface and theoretical study for Nonlinear Optical (NLO) properties of novel copper complexes: Bis(2,9-dimethyl-1,10-phenanthroline)-copper perchlorate and bromidobis(1,10-phenanthroline)-copper
  作者：Ruchika Jaryal、Shamshad Ahmad Khan

  DOI：10.1016/j.molstruc.2023.136254

  日期：2023.12

  5317(15) Å and β = 97.677(6)o. The FMOs study based on DFT showed the complex (2) has high value of chemical softness and more easily polarized compare to complex (1). The HOMO-LUMO energy gap in complex (2) is small compared to complex (1) due to which there is easier intramolecular charge transfer (ICT) in complex (2) which support the higher third order NLO (γ) response of the complex (2). The statistical

  通过液体辅助合成了两种新型Cu(I)配合物，[Cu(dmp) 2 ]ClO 4与2,9-二甲基菲咯啉(dmp)和[Cu(phen) 2 Br]与1,10-菲咯啉(phen)研磨（LAG）方法，然后加热。使用 SC-XRD、FT-IR 和紫外-可见光谱技术对配合物进行了表征。配合物(1) [Cu(dmp) 2 ]ClO 4呈斜方晶系结晶，空间群为 P 21 21 21，a = 11.9229 (2) Å，b = 12.4823(3) Å，c = 18.2499(3) Å和络合物(2) [Cu(phen) 2Br]以单斜晶系结晶，空间群为C2/c，a = 23.247(5) Å，b = 30.731 (6) Å，c = 7.5317(15) Å，β = 97.677(6) o。基于DFT的FMOs研究表明，与配合物（1）相比，配合物（2）具有较高的化学柔软度并且更容易极化。与配合物(1)相比，配合物(2