silver(I) di(4-chlorobenzenesulfonyl)amide | 114206-08-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: silver(I) di(4-chlorobenzenesulfonyl)amide
• 英文别名: silver(I)-di(4-chlorobenzolsulfonyl)amide；silver bis(p-chlorobenzenesulfonyl)amide；silver;bis[(4-chlorophenyl)sulfonyl]azanide
• CAS: 114206-08-5
• 化学式: Ag*C₁₂H₈Cl₂NO₄S₂
• 分子量: 473.106
• InChiKey: XJCLUZBYRDQYJM-UHFFFAOYSA-N

物化性质

• 熔点：
  275-280 °C (decomp)

计算性质

• 辛醇/水分配系数(LogP)：
  3.44
• 重原子数：
  22.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  82.38
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  silver(I) di(4-chlorobenzenesulfonyl)amide 以 乙腈 为溶剂， 生成 bis(cyclohexylamine)gold(I) bis(p-chlorobenzenesulfonyl)amide
  参考文献：
  名称：

  聚磺胺，CXXVIII [1]。Disulfonyamido-Gold(I)-Komplexe mit Tetrahydrothiophen als Ligand / Polysulfonyamines, CXXVIII. 以四氢噻吩为配体的二磺酰氨基金(I)配合物

  摘要：

  分子金（I）络合物二（甲磺酰基）酰胺基-/V-（四氢噻吩）金（I）（1），二（对氯苯磺酰基）酰胺基-/V-（四氢噻吩）金（I）（2），和二（对碘苯磺酰基）酰氨基-/V-（四氢噻吩）金（I）（3）由（四氢噻吩）氯金（I）和适当的银盐合成。对所有三种化合物（3 种均不含溶剂且作为二氯甲烷溶剂化物 3a）进行了晶体结构分析，并揭示了多种分子间接触。化合物 1 结晶有四个独立的分子，其中两个通过 3.2869(8) Å 的金-金相互作用连接；观察到几个CH·O形式的短非经典氢键（最短的H·O为2.31 A）。在化合物 2 中，环二聚体是通过 3.3302(8) Å 的 Au·Au 接触形成的；另外Cl·Cl触点3。观察到 457(3) Å。化合物 3 的两种形式都以 Au·I 接触为特征，3 (3.6 - 4.3 Å) 比 3a (3.4 - 3.5 Å) 稍长。2、3 和 3a 中的二（芳烃磺酰基）酰胺配体显示近似

  DOI：

  10.1515/znb-2000-0904
• 作为产物：
  描述：

  4-氯-N-[(4-氯苯基)磺酰基]-苯磺酰胺 以 水 为溶剂， 生成 silver(I) di(4-chlorobenzenesulfonyl)amide
  参考文献：
  名称：

  Blaschette, Armand; Jones, Peter G.; Hamann, Thomas, Zeitschrift fur Anorganische und Allgemeine Chemie

  摘要：

  DOI：

文献信息

• Polysulfonylamine, CLXXXVIII [1]. Kristallstrukturen von drei Dimethylammonium-di(4-halogenbenzolsulfonyl)amiden (Halogen = Cl, Br, I) und von Dimethylammonium-di(4-methylbenzolsulfonyl)amid: Eine isotype Reihe mit strukturbestimmenden starken Wasserstoffbrücken und beiläufigen Halogenbrücken/ Polysulfonylamines, CLXXXVIII. Crystal Structures of Three Dimethylammonium Di(4-halobenzenesulfonyl)amides (Halogen = Cl, Br, I) and of Dimethylammonium Di(4-methylbenzenesulfonyl)amide: An Isotypical Series Featuring Strong Structure-determining Hydrogen Bonds and Incidental Halogen Bonds
  作者：Christoph Wölper、Alejandra Rodríguez-Gimeno、Matthias Freytag、Peter G. Jones、Armand Blaschette

  DOI：10.1515/znb-2010-1013

  日期：2010.10.1

  The four title compounds, Me₂NH₂ ⁺·(4-Cl/Br/I/Me-C₆H₄-SO₂)₂N^-, were obtained by metathesis of dimethylammonium chloride with the corresponding silver di(arenesulfonyl)amides. The products crystallize isotypically in the monoclinic space group Cc (Z = 4, Z´ = 1). In each structure, the ionic entities associate into hydrogen-bonded chains, which propagate along the c axis of the crystals and consist of alternating cations and anions held together by charge-assisted N⁺-H· · ·N− and N⁺- H(· · ·O)₂ hydrogen bonds. In the three structures containing 4-halobenzenesulfonyl groups, each hydrogen-bonded chain is linked to four neighboring chains by pairs of C-Cl/Br/I· · ·O halogen bonds, which at first sight seem to be the causative factor in the formation of catemeric head-to-tail arrays of anions propagating along the ab face diagonals. On suppressing these halogen bonds by means of halogen-methyl exchange, all essential features of the packing architecture, including the anion headto- tail arrays, are precisely maintained. It may be thus inferred that the halogen bonds occurring in the first three compounds are supportive incidentals, but do not play any structure-determining role.

  四种化合物的名称为Me2NH2+·(4-Cl/Br/I/Me-C6H4-SO2)2N-, 它们是通过二甲基氨基盐酸盐与相应的银二(芳烃磺酰)胺发生交换反应得到的。这些产物以单斜晶系Cc空间群（Z = 4, Z' = 1）的同构晶体结构形式结晶。在每个结构中，离子实体通过氢键链结合在一起，这些链沿着晶体的c轴传播，由交替的阳离子和阴离子组成，通过电荷辅助的N+ -H···N-和N+ -H(···O)2氢键相互保持。在含有4-卤代苯磺酰基的三个结构中，每个氢键链通过成对的C-Cl/Br/I···O卤键与四个相邻链相连，这些卤键似乎是导致沿着ab面对角线传播的阴离子链的串联头尾排列的原因。通过卤代甲基交换抑制这些卤键后，所有包装结构的基本特征，包括阴离子头到尾排列，都得到了精确维持。因此，可以推断出前三种化合物中出现的卤键是支持性的附带因素，但并不起任何结构决定作用。
• Secondary Interactions in Gold(I) Complexes with Thione Ligands, 4. Three Further Salts of the Bis(imidazolidine-2-thione)gold(I) Cation [1, 2]
  作者：Steffi Friedrichs、Peter G. Jones

  DOI：10.1515/znb-2006-1112

  日期：2006.11.1

  Three structures of the form bis(imidazolidine-2-thione)gold(I) disulfonylamide [disulfonylamide = benzene-1,2-di(sulfonyl)amide (1), di(4-chlorobenzenesulfonyl)amide (2), di(4-iodobenzenesulfonyl) amide (3)] were determined. Compound 3 crystallizes with four independent formula units. The cations in 1 and 3 show an antiperiplanar conformation about the S···S axis, whereas the corresponding torsion angle in 2 is 72°. The packing in 1 consists of linked ribbons in which the NH groups of neighbouring cations are bridged by O-S-O groups of the anions. Compound 2 exhibits a complex layer structure in which several multi-centre hydrogen bonds are observed. The structural subunits of compound 3 involve an alternating anion-cation chain for two of the cations and inversionsymmetric anion-cation dimers for the other two cations. Short C-H···Au contacts (shortest H···Au 2.63 Å in 2) contribute to the packing of compounds 2 and 3.

  本文报道了三种形式的二咪唑啉-2-硫酮金(I)双磺酰胺结构，其中[双磺酰胺 = 苯-1,2-二(磺酰)胺(1)，二(4-氯苯磺酰)胺(2)，二(4-碘苯磺酰)胺(3)]。化合物3晶体中含有四个独立的分子式单位。化合物1和3中的阳离子在S···S轴周围呈反平面构象，而化合物2中的相应扭曲角度为72°。化合物1的堆积由相邻阳离子的NH基团和阴离子的O-S-O基团桥接的连续带状链组成。化合物2呈现出复杂的层状结构，其中观察到多中心氢键。化合物3的结构亚单位涉及两个阳离子的交替阴离子-阳离子链和另外两个阳离子的反演对称阴离子-阳离子二聚体。短C-H···Au接触(在化合物2中最短的H···Au为2.63Å)有助于化合物2和3的堆积。
• Ahrens, Birte; Friedrichs, Steffi; Herbst-Irmer, Regine, European Journal of Inorganic Chemistry, 2000, # 9, p. 2017 - 2029
  作者：Ahrens, Birte、Friedrichs, Steffi、Herbst-Irmer, Regine、Jones, Peter G.

  DOI：——

  日期：——
• Polysulfonylamine. LXXX [1]. Darstellung und Kristallstrukturen einiger Gold(I)-Komplexe mit Disulfonylamid-Liganden
  作者：Peter G. Jones、Armand Blaschette、J�rgen Lautner、Carsten Th�ne

  DOI：10.1002/zaac.199762301122

  日期：——

  AbstractKomplexe der Form Ph3PAuL (L = Disulfonylamid‐Ligand) lassen sich bequem aus Ph3PAuX (X = Halogenid) und dem entsprechenden Silber‐Disulfonylamid synthetisieren. Kristallstrukturbestimmungen von vier solchen Komplexen zeigen folgende gemeinsame Merkmale: (i) Die Koordination am Gold‐Zentrum ist linear; (ii) keine kurzen intermolekulare Kontakte werden beobachtet; (iii) es gibt kurze intramolekulare Kontakte zwischen Gold und je zwei Sauerstoffatomen von L; (iv) die S–N‐Bindungslängen entsprechen einem Bindungsgrad von ca. 1,4.
• Polysulfonylamine
  作者：Armand Blaschette、Ilona Lange、Jürgen Krahl、Dietrich Koch、Peter G. Jones

  DOI：10.1016/0022-328x(94)80003-0

  日期：1994.3

  By reacting R3SnCl with AgN(SO2R)2 and/or R3SnOH with HN(SO2R)2, the following compounds were obtained: R3SnN(SO2Me)2, where R = Et (3), (n)Bu, Ph (5) or (c)Hex (6); Me3SnN(SO2C6H4Cl-p)2; Me3SnZ and Me3SnZ . H2O (Z = anion of benzene-1,2-disulfonimide). With dimethyl sulfoxide, 3 gives the 1/2 complex Et3SnN(SO2Me)2 . 2DMSO. An improved method of preparation is described for the structurally known aqua complex [Me3Sn(OH2)2]+[(MeSO2)2N]-. From equimolar amounts of 5 and Ph3SnOH, a 1/1 adduct is obtained, which crystallizes from acetonitrile as a labile disolvate Ph3SnN(SO2Me)2 . Ph3SnOH . 2MeCN (12a); the latter readily loses one MeCN molecule to give the more stable monosolvate. The crystallographic data are for 5 (at -95-degree-C): orthorhombic, space group Pna2(1), a 1460.9(5), b 1086.3(4), c 1344.8(4) pm, V 2.1342 nm3, Z = 4; for 6 (at -100-degrees-C): triclinic, space group P1BAR, a 1004.6(2), b 1362.6(3), c 1964.2(4) pm, alpha 81.48(2), beta 75.35(2), gamma 70.98(2)-degrees, V 2.4529 nM3, Z = 4; for 12a (at -100-degrees-C): orthorhombic, space group P2(1)2(1)2(1), a 1001.8(2), b 1873.0(5), c 2237.8(4) pm, V 4.1989 nm3, Z = 4. The crystals of 5 and 6 consist of infinite chains built from R(3)Sn groups with trigonal-planar SnC3 skeletons and (alpha-O,omega-O)-bridging dimesylamide ligands, resulting in a slightly distorted trigonal-bipyramidal (C3O2) coordination of the tin atoms (one Sn in the repeat unit of 5, two independent Sn atoms in the repeat unit of 6). The tin-oxygen distances are in the range 226-235 pm. 6 appears to be the first example of a structurally characterized tricyclohexyltin compound in which (c)Hex3Sn groups with an essentially planar SnC3 geometry are incorportated into a polymeric chain. In the structure of 12a, Ph3Sn groups are connected into infinite chains by alternating mu-O(H) and (alpha-O,omega-O)-bonded dimesylamide groups; the two independent tin atoms adopt a distorted trigonal-bipyramidal (C3O2) coordination. The bond lengths Sn-O(H) and Sn-O(S) are 213.6 and 244.0 pm for Sn(1), 212.1 and 259.0 pm for Sn(2); the bond angle Sn(1)-O(H)-Sn(2) is 139.2-degrees. One MeCN molecule is hydrogen-bonded to the mu-O(H) group, the second lies in a lattice cavity between neighbouring chains.