p-[Co(tris(2-aminoethyl)amine)(NH3)Cl]Cl*ClO4 | 54713-96-1

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机含氧阴离子化合物
• 英文名称: p-[Co(tris(2-aminoethyl)amine)(NH3)Cl]Cl*ClO4
• 英文别名: azane;N',N'-bis(2-aminoethyl)ethane-1,2-diamine;dichlorocobalt(1+);perchlorate
• CAS: 54713-96-1；73958-75-5
• 化学式: C₆H₂₁ClCoN₅*ClO₄*Cl
• 分子量: 392.616
• InChiKey: JRRLKZUIHZWAOE-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：

  p-[Co(tris(2-aminoethyl)amine)(NH3)Cl]Cl*ClO4 在 sodium nitrate 、 sodium perchlorate 作用下， 以 高氯酸 为溶剂， 生成
  参考文献：
  名称：

  Buckingham, David A.; Clark, Charles R.; Webley, Wayne S., Australian Journal of Chemistry, 1980, vol. 33, p. 263 - 272

  摘要：

  DOI：

文献信息

• Crystal Structures of Oxalato and Oxamido Polyaminecobalt(III) Complexes Produced by Hydrolysis of Monooxamide
  作者：Hyungphil Chun、Bobby J. Salinas、Ivan Bernal

  DOI：10.1002/(sici)1099-0682(199904)1999:4<723::aid-ejic723>3.0.co;2-d

  日期：1999.4

  trans-[Co(en)2Cl2]Cl, trans-[Co(3,2,3-tet)Cl2]Cl (3,2,3-tet = 1,5,8,12-tetraazadodecane), cis-α-[Co(trien)Cl2]Cl and [Co(tren)Cl2]Cl result in the formation of [Co(en)2(ox)]Cl · 4H2O (1), cis-β-[Co(3,2,3-tet)(ox)]Cl· 4 H2O (2), cis-α-[Co(trien)(ox)]Cl · 2 H2O (3), and [Co(tren)(ox)](ClO4) · 0.5 H2O (4) respectively, implying a hydrolytic cleavage of the amide bond. [Co(tren)(O,O′-oxam)]Cl2 · 2 H2O (5)

  单草酰胺钠 (H2NCOCO2Na) 与反式-[Co(en)2Cl2]Cl、反式-[Co(3,2,3-tet)Cl2]Cl (3,2,3-tet = 1,5,8) 的反应,12-四氮杂十二烷), cis-α-[Co(trien)Cl2]Cl 和 [Co(tren)Cl2]Cl 导致形成 [Co(en)2(ox)]Cl · 4 (1), cis -β-[Co(3,2,3-tet)(ox)]Cl·4 H2O (2)、顺-α-[Co(trien)(ox)]Cl·2 (3) 和 [Co (tren)(ox)](ClO4) · 0.5 (4) 分别表示酰胺键的水解裂解。[Co(tren)(O,O'-oxam)]Cl2 · 2 (5) (oxam = H2NCOCO2−) 和 p-[Co(tren)(NH3)(O-oxam)]Cl2 (6) 也有制备是为了提供单草酰胺水解
• Syntheses of K[Co(tren)(NH3)(SO4)](S4O6)·2(H2O) and of [cis-α-Co(trien)(NH3)Cl](S5O6) – Compounds Produced by Hydrolytic Cleavage of Sulfur–Sulfur Bonds of the Tetrathionate Anion
  作者：Hyungphil Chun、Ivan Bernal

  DOI：10.1002/(sici)1099-0682(199904)1999:4<717::aid-ejic717>3.0.co;2-1

  日期：1999.4

  K[Co(tren)(NH3)(SO4)](S4O6)·2(H2O) (1) and [cis-α-Co-(trien)(NH3)Cl](S5O6) (2) have been prepared unexpectedly while attempting to obtain crystals suitable for X-ray diffraction of [Co(tren)(NH3)Cl](S4O6) (3) and of [cis-Co(trien)(NH3)Cl](S4O6) (4), respectively. 1 is derived from 3 by hydrolysis of the tetrathionate anion resulting in a sulfato moiety which displaces the chloro ligand from the coordination

  K[Co(tren)(NH3)(SO4)](S4O6)·2(H2O) (1) 和 [cis-α-Co-(trien)(NH3)Cl](S5O6) (2) 意外制备同时试图获得分别适用于 [Co(tren)(NH3)Cl](S4O6) (3) 和 [cis-Co(trien)(NH3)Cl](S4O6) (4) 的 X 射线衍射的晶体. 1 衍生自 3，通过四硫酸盐阴离子的水解产生硫酸根部分，该部分从金属中心的配位球中置换氯配体。如 Steudel 之前的色谱工作中所述，2 是通过连四硫酸盐阴离子的水解，然后再转化为连五硫酸盐阴离子和 H2S 衍生自 4 的。化合物 1 和 2 已通过元素分析和单晶 X 射线衍射研究进行表征。
• Reactivity of a Regiospecific Ion Pair. Comparisons of Cl^- and H₂O Entry into the Five-Coordinate Intermediate Generated from<i> p</i>-[Co(tren)(NH₃)OH₂]³⁺·Cl^-
  作者：Nicola E. Brasch、David A. Buckingham、Charles R. Clark、Jim Simpson

  DOI：10.1021/ic960653+

  日期：1996.1.1

  Equilibration in the system : p-[Co(tren)(NH3)OH2](3+) + Cl- reversible arrow p-[Co(tren)(NH3)Cl](2+) + H2O (p-stereochemistry has the labile group (OH2, Cl-) trans to a tren NH2) in aqueous solution of variable (I = 0-2.0 M) and constant (I = 2.0 M, NaClO4) ionic strength at 37.5 degrees C is described by the following rate law: k(obs) = k(aq) + k(an)K(Cl)[Cl-]/(1 + K-Cl[Cl-] + K-ClO4[ClO4-]); K-Cl (0.64 M(-1)) and K-ClO4, (0.21 M(-1)) correspond to ion pairing of Cl- and ClO4- to the aqua complex and k(aq) (1.4 x 10(-5) s(-1)) and k(an) (1.2 x 10(-4) s(-1)) to the rate constants for aquation of the chloro complex and anation of the ion-paired (Cl-) aqua complex respectively. The rate constant for loss of coordinated (OH2)-O-17 from the labeled aqua complex is the same (k(OH2) similar to 1.2 x 10(-4) s(-1)) irrespective of the presence (2.0 M) or absence of NaClO4 ([H+] = 0.10 M, 37.5 degrees C) but increases with increasing [Cl-] to reach a limit (similar to 2.4 x 10(-4) s(-1)) at high concentrations (range 0-1.90 M; I = 2.0 M, NaClO4). Water exchange in the p-[Co(tren)(hTH(3))OH2](3+). Cl- ion pair (K-OH2 = 1.2 x 10(-4) s(-1)) occurs just as readily as anation. A mechanism for anation is suggested whereby entry of Cl- ion and OH2 molecules from positions adjacent to the p-sire affects reentry of the original OH2 ligand such that all processes are partly rate determining, A combination of 1D nOe and 2D COSY spectroscopy (DMSO-d(6) solvent) has allowed all the H atoms in p-[Co(tren)(NH3)OH2](3+) and p-[Co(tren)(NH3)Cl](2+) to be assigned. Added Cl- ion strongly influences the chemical shifts of the OH2, NH3, and NH hydrogens in the aqua complex (in decreasing order of importance) and appears to associate more strongly than ClO4-. Anation in DMSO occurs without the intermediacy of the DMSO complex. The crystal structure of p-[Co(tren)(NH3)OH2]Cl-3, orthorhombic, Pmn2(1), a = 11.689(6) Angstrom, b = 8.215(3) Angstrom, c = 6.878(2) Angstrom, Z = 2, and R = 0.0490 shows one unique Cl- ion (Cl(1)) H-bonded to the OH2 and NH3 ligands of the complex cation(distances 2.89 and 3.96 Angstrom respectively). Heating the crystalline solid results in rapid Cl- entry.
• Brasch, Nicola E.; Buckingham, David A.; Clark, Charles R., Inorganic Chemistry, 1998, vol. 37, # 19, p. 4865 - 4871
  作者：Brasch, Nicola E.、Buckingham, David A.、Clark, Charles R.、Rogers, Andrew J.

  DOI：——

  日期：——
• 10.1002/(sici)1099-0682(200001)2000:1<189::aid-ejic189<3.0.co;2-v
  作者：Chun, Hyungphil、Jackson, W. Gregory、McKeon, Josephine A.、Somoza Jr., Fernando B.、Bernal, Ivan

  DOI：10.1002/(sici)1099-0682(200001)2000:1<189::aid-ejic189<3.0.co;2-v

  日期：——