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1.
《Journal of Coordination Chemistry》2012,65(1-4):17-22
Abstract We report a new crystal structure of the title clathrate containing tetrahedral and octahedral Cd atoms in a ratio of 1:1. The preparation of the compound is similar to that of the cristobalite-like clathrate Cd(CN)2·G, where all Cd atoms are tetrahedral. The new inclusion compound crystallizes in the monoclinic space group C2/c, a = 12.337(4), b = 11.964(3), c = 13.594(3) Å, β = 108.60(2)°, Z = 4, R = 0.034 for 1631 reflections. The three-dimensional host framework is built of alternate linkages between the tetrahedral Cd atom of the tetracyanocadmate and the octahedral Cd atom similar to that of the Hofmann-Td and the en-Td types. In the new clathrate dual behavior of acetonitrile, one as a unidentate ligand in the three-dimensional host framework and the other as the guest in the cage-like cavity, has been demonstrated. 相似文献
2.
《Journal of Coordination Chemistry》2012,65(5):427-431
A new dinuclear Cd(II) complex, [L2Cd2(μ-N3)2(N3)2], containing two end-on bridging azide ligands, two monodentate N3 ligands and 1,4,7-triazacyclononane as the capping ligand, has been synthesized and its structure determined by X-ray crystallography. The complex crystallizes in the monoclinic space group P21/c with a=8.467(3), b=14.359(5), c=10.115(4)Å, β=95.026(6)° and z=4. The cadmium(II) centre is six-coordinate with distorted octahedral geometry, bonded to three N atoms of the 1,4,7-triazacyclononane, two nitrogen atoms of μ-azide bridges and one nitrogen atom of a monodentate azide ligand. Neighboring Cd(II) atoms are linked by the double end-on azide bridges. 相似文献
3.
《Journal of Coordination Chemistry》2012,65(2-3):207-215
Abstract A new manganese(III) complex [HimH][Mn(sal)2(imH)2]CH3OH (sal = salicylate, C7H4O3 2-; imH = imidazole, C3H4N2; [HimH]+ = imidazole cation (C3H5N2) has been prepared and characterized by X-ray analysis and magnetic measurements. The compound crystallizes in the monoclinic space group P2 1 with a = 9.931(2), b = 10.237(1), c = 12.926(7) Å, β = 102.740° and Z = 2. The structure has been refined to R = 0.030 and Rw = 0.031. The Mn(III) ion has elongated octahedral coordination with mutually trans imidazoles occupying axial sites. The equatorial plane is defined by four O atoms of two salicylates. Each [HimH]+ cation (imidazolium) is associated with two complex anions through hydrogen bonds as an imidazolium bridge. The variable temperature magnetic susceptibility for the complex in the temperature range 77-300 K has been interpreted in terms of a single-ion zero-field splitting model with a molecular field term correction. The values obtained for D, g. and zj' are -6.93 cm?1, 2.00 and -0.90 cm?1. 相似文献
4.
《Journal of Coordination Chemistry》2012,65(13):2150-2156
One-dimensional manganese(II) complex, [Mn2(5-nbdc)2(imH)6] · 2H2O (1) (5-nbdcH2 = 5-nitro-1,3-benzenedicarboxylic acid and imH = imidazole), has been hydrothermally synthesized and structurally characterized by X-ray crystallography with the following data: orthorhombic, space group Pna2(1), M r = 972.63 for Mn2C34H34N14O14, a = 13.3391(12) Å, b = 16.4657(15) Å, c = 18.2177(16) Å; V = 4001.3(6) Å3, Z = 4, D calcd 1.615 g cm?3, µ = 0.718 mm?1, the final R = 0.0490 and wR = 0.1277 for 7278 observed reflections (I > 2σ(I)). Complex 1 exhibits very weak intra-chain ferromagnetic coupling (J k?1 = 0.001 K) with g = 1.930. The magnetism of a one-dimensional cobalt(II) complex [Co(5-nbdc)2(imH)2] n (2) indicates weak intra-chain anti-ferromagnetic coupling (J k?1 = ?0.067 K) with g = 2.0791. 相似文献
5.
Saeed Ahmad Mohammed Fettouhi Thierry Roisnel Mshari A. Alotaibi Abdulrahman I. Alharthi Muhammad Riaz Malik 《Journal of Coordination Chemistry》2017,70(21):3692-3701
Cadmium(II) complexes, catena-poly[bis(thiocyanato-κN)bis(N-methylthiourea)cadmium(II)], [Cd(Metu)2(NCS)2]n (1) and dicyanidobis(N-methylthiourea)cadmium(II), [Cd(Metu)2(CN)2] (2) were prepared and their structures were determined by single crystal X-ray analysis. In 1, the cadmium(II) ion is bound to four sulfur atoms of bridging Metu ligands and two nitrogen atoms of thiocyanate adopting a distorted octahedral environment. In 2, the geometry around cadmium is distorted tetrahedral attained by two cyanide ions and two methylthiourea molecules bound through the sulfur atoms. The crystal structures of both complexes show intra and intermolecular hydrogen bonding interactions. The complexes were also characterized by IR and NMR spectroscopy and the spectroscopic data were discussed in terms of the nature of bonding. 相似文献
6.
Repická Zuzana Moncol Jan Puchoňová Miroslava Jorík Vladimír Mikloš Dušan Lis Tadeusz Padělková Zdenka Mazúr Milan Valigura Dušan 《Structural chemistry》2010,21(5):1093-1102
Novel copper(II) X-salicylate complexes with N,N-diethylnicotinamide (dena) of the formula [Cu(RCOO)2(dena)2(H2O)2] (RCOO = 3-methylsalicylate anion (3-Mesal, 1), 4-methylsalicylate anion (4-Mesal, 2), 5-methylsalicylate anion (5-Mesal, 3), 5-methoxysalicylate anion (5-MeOsal, 4) or 4-methoxysalicylate anion (4-MeOsal, 5)), and complex [Cu(3-MeOsal)2(dena)2(H2O)2]∙2H2O (3-MeOsal = 3-methoxysalicylate anion (6)) have been prepared in the crystalline forms and characterized by spectroscopic methods (IR, Vis–UV, EPR). All the compounds
according to their composition (1–5) seem to possess octahedral copper(II) stereochemistry. The complex 1 has been prepared in two different forms. X-ray analyses of the complexes 1, 4, and 5 were carried out and they featured a tetragonal-bipyramidal geometry around the copper atoms. The tetragonal planes are created
by X-salicylate anions bonded to the copper(II) atoms via unidentate carboxylate oxygen atoms and the pyridine ring nitrogen
atoms of the neutral ligand N,N-diethylnicotinamide, while in axial positions are water molecules. The two forms of complex 1 present conformation polymorphs and supramolecular isomers. 相似文献
7.
Turan Kaya Yazıcılar Evrim Yılmaz Gürkan İbrahim Uçar Canan Kazak 《Transition Metal Chemistry》2009,34(6):669-676
Four novel transition metal benzenesulfonate (BS) complexes of imidazole (im) with a general formula [M(imH)3(H2O)3]·(BS)2 [M=Mn(II) (1), Ni(II) (2), Co(II) (3)] and [Cu(BS)(imH)3]·(BS) (4) have been synthesized and characterized by physicochemical and spectroscopic methods. The complexes 2 and 3 have also been characterized by single X-ray diffraction technique. The BS anion in complexes 1–3 acts as a counter anion, while in complex 4, it acts as both ligand and counter anion. The Ni and Co complexes are isomorphous, crystallizing in the monoclinic crystal
system with C2/c space group. Each metal(II) atom in 2 and 3 is octahedrally coordinated by three imidazole and three aqua ligands, adopting a mer-coordination mode with Ni(II) or Co(II) centers. In both 2 and 3, the H2C atom has bifurcated donor (O3 and O5) atoms, forming a bifurcated hydrogen bond. This hydrogen bond links the complex
cation and BS anion, forming one-dimensional hydrogen-bonded supramolecular chains. The complexes exhibit different decomposition
characteristics. Magnetic susceptibility measurement shows that complex 3 has orbital interactions. 相似文献
8.
《Journal of Coordination Chemistry》2012,65(7):727-734
The reaction products of Cu(II) 2-chlorobenzoate and imidazole (1), and of Cu(II) 2,3-dichlorobenzoate and imidazole (2) formulated as CuL'2·3imd and CuL"·3imd (L' = C7H4ClO2, L" = C7H4Cl2O2 ?, imd = imidazole), were prepared and characterized by means of structural and spectroscopic measurements and thermochemical properties. The blue (1) and green (2) compounds crystallize in the monoclinic system with space group C2/c, cell parameters a = 20.753(4), b = 8.414(2), c = 14.429(3) Å, β = 90.15(3)°, V = 2519.5(9) Åsup3;, Z = 4 for (1) and a = 21.335(4), b = 8.417(2), c = 15.030(3) Å, β = 94.11(3)°, V = 2692.1(10) Åsup3;, Z = 4 for (2). The complexes decompose at 483 K. 相似文献
9.
《Journal of Coordination Chemistry》2012,65(3):390-399
Coordination polymers, {[Cd(2-mBIM)3](ClO4)2} n (1) and [Cd(BIM)2(NO3)2] n (2), have been prepared from the reaction of bis(2-methylimidazol-1-yl)methane(2-mBIM) with Cd(ClO4)2 and bis(imidazol-1-yl)methane (BIM) with Cd(NO3)2 in ethanol and water, respectively. Their structures were characterized by single crystal X-ray diffraction and IR spectroscopy. Compound 1 crystallizes in the rhombohedral space group R-3c with a = b = 12.3617(5) Å, c = 38.896(3) Å, γ = 120°, V = 5147.5(5) Å3, z = 6. The CdII occupies a crystallographic inversion center and is coordinated by six N atoms from six distinct 2-mBIM ligands to form a slightly distorted octahedral geometry. Each 2-mBIM is coordinated to two CdII cations, linking alternatively four CdII cations, resulting in a 32-membered M4L4 macrometallacycle. Compound 2 crystallizes in the monoclinic space group C2/m with a = 14.400(3) Å, b = 9.3894(18) Å, c = 8.6926(17) Å, β = 123.499(2)°, V = 980.1(3) Å3, z = 2. The Cd coordinates to four nitrogen atoms from four different BIM and two nitrates to form a slightly distorted octahedral geometry. The BIM ligands bridge to form a 1-D infinite double-bridged chain structure with 16-membered M2L2 macrometallacyclic structural units. 相似文献
10.
《Journal of Coordination Chemistry》2012,65(1):7-13
Abstract A novel polymeric μ-BTC complex of Mn(II) with imidazole has been synthesized, where BTC is the 1,2,4,5-benzenetetracarboxylato tetravalent anion, and its crystal structure has been determined by X-ray diffraction methods. The complex crystallizes in the monoclinic spacegroup P21/n with a = 11.184(5), b = 9.177(2), c = 18.243(1)Å and β = 107.84(1)°. Each BTC ligand, located around the crystallographic inversion centre, bridges four Mn(II) atoms through four carboxyl groups to form a three dimensional polymeric structure. The carboxyl groups in the ortho-position of BTC bridges Mn(II) atoms related by the crystallographic screw axis to form helical complex chains along the b axis. Coordination around the Mn(II) atom is distorted octahedral; two BTC anions coordinate to Mn(II), one in unidentate fashion and the other as a chelate. The coordination distance of the unidentate ligand is much shorter than in the chelated ligand. 相似文献
11.
Laila H. Abdel-Rahman 《Transition Metal Chemistry》2006,31(7):943-950
A new series of N-phthaloylglycineate (N-phthgly) ternary complexes of cobalt(II) and nickel(II) with imidazole (imi), N-methylimidazole
(mimi) and 2,2′-bipyridyl (bipy) have been synthesized and characterized by elementary analyses, IR spectroscopy, thermogravimetric
analysis. X-ray crystal structure analyses of the three complexes of [Co(mimi)2(N-phthgly)2] (1), [Co(bipy)(OH2)4](N-phthgly)2
(2) and [Ni(imi)2(N-phthgly)2(OHCH3)2] (3) were also carried out. In complex (1), the Co(II) exists in a distorted tetrahedral enviroment, where two nitrogen atoms of two methylimidazole molecules and two
oxygen atoms of the carboxylate group of two N-phthaloylglycinate molecules are coordinated. On the other hand, in complex
(2) the cobalt atom coordinates a 2,2′-bipyridine molecule and four water oxygen atoms forming a distorted octahedral conformation.
A molecule of N-phthaloylglycinate is connected by van der waals contact and H-bonds. For complex (3), the nickel atom is surrounded by four oxygens (two oxygens of two different N-phthaloylglycinate molecules and two of methanol
ligand) in the basal plane of octahedron along with two imidazole nitrogen atoms at the apical positions. Strong intramolecular
H-bond exists between the uncoordinated carboxylic oxygen of the N-phthaloylglycinate ligand and the O–H of the methanol group. 相似文献
12.
Wang Yao Yu Zhou Li Jun Shi Qian Shi Qi Zhen Gao Yi Ci Hou Xun 《Transition Metal Chemistry》2002,27(2):145-148
A MeOH solution of imidazole reacts with Cu2A4(H2O)2 [A = CH2=CHCO–
2, CH2=C(Me)CO–
2] to yield novel trinuclear copper(II) carboxylate complexes of general formula: Cu3A5(OH)(imH)3 [(1) A=CH2=CHCO–
2; (2) A = CH2=C(Me)CO–
2; imH = imidazole]. The crystal structure of (2) has been determined. The geometry of one copper(II) atom is distorted trigonal bipyramidal, and the other two copper(II) atoms are distorted square-planar. The i.r. spectra show the presence of the absorption bands of both bidentate
2-O,O and monodentate carboxylate ligands. The electronic reflectance spectra in the solid state suggest that the d–d transitions of complexes are in a trigonal bipyramidal ligand field and a square-planar ligand field. Room temperature X-band e.s.r. spectra of powdered samples with g
av = 2.140 for (1) and g
av = 2.092 for (2), indicate that there is no spin coupling between the copper(II) atoms. 相似文献
13.
《Journal of Coordination Chemistry》2012,65(8):1446-1455
A functionalized ligand (L?=?1,4,8,11-tetrakis(3-pyridylmethyl)-1,4,8,11-tetraazacyclotetradecane) was synthesized by the reaction of 1,4,8,11-tetraazacyclotetradecane (cyclam, L1) with 3-(chloromethyl)pyridine hydrochloride. Hydrothermal reactions between L and two Cd(II) salts (nitrate or chloride) led to the formation of [CdCl2(µ4-4(pyridyl)L)] n (1) and [Cd(µ-ONO2)2(µ4-4(pyridyl)L)] n (2), which were characterized by elemental analysis and single-crystal X-ray diffraction. In 1, Cd is six-coordinate, with a CdN4Cl2 octahedral coordination environment forming two metallamacrocycles with the functionalized cyclam. In the structure of 2, the metal possesses a distorted CdN4O2 octahedral coordination geometry, also presenting two metallamacrocycles. In both structures, the ligand does not chelate, but forms extended polymeric structures. 相似文献
14.
《Acta Crystallographica. Section C, Structural Chemistry》2018,74(10):1128-1132
Imidazole‐4,5‐dicarboxylic acid (H3IDC) and its derivatives are widely used in the preparation of new coordination polymers owing to their versatile bridging coordination modes and potential hydrogen‐bonding donors and acceptors. A new one‐dimensional coordination polymer, namely catena‐poly[[diaquacadmium(II)]‐μ3‐2,2′‐(1,2‐phenylene)bis(1H‐imidazole‐4,5‐dicarboxylato)], [Cd(C16H6N4O8)0.5(H2O)2]n or [Cd(H2Phbidc)1/2(H2O)2]n, has been synthesized by the reaction of Cd(OAc)2·2H2O (OAc is acetate) with 2,2′‐(1,2‐phenylene)bis(1H‐imidazole‐4,5‐dicarboxylic acid) (H6Phbidc) under solvothermal conditions. In the polymer, one type of Cd ion (Cd1) is six‐coordinated by two N atoms and two O atoms from one H2Phbidc4− ligand and by two O atoms from two water molecules, forming a significantly distorted octahedral CdN2O4 coordination geometry. In contrast, the other type of Cd ion (Cd2) is six‐coordinated by two N atoms and two O atoms from two symmetry‐related H2Phbidc4− ligands and by two O atoms from two symmetry‐related water molecules, leading to a more regular octahedral coordination geometry. The Cd1 and Cd2 ions are linked by H2Phbidc4− ligands into a one‐dimensional chain which runs parallel to the b axis. In the crystal, the one‐dimensional chains are connected through hydrogen bonds, generating a two‐dimensional layered structure parallel to the ab plane. Adjacent layers are further linked by hydrogen bonds, forming a three‐dimensional structure in the solid state. 相似文献
15.
《Journal of Coordination Chemistry》2012,65(6):675-680
A neutral mononuclear complex [Cu(cbIm)4(NO3)2] (cbIm = 4'-cyanobenzyl-1-imidazol) was synthesized and characterized by x-ray crystallography. It crystallizes in the triclinic space group P-1 with a = 8.249(2), b = 8.735(2), c = 16.597(2) Å, f = 81.980(10), g = 88.540(10), n = 63.570(10)° and Z = 2. The final refinement of the structure leads to R and Rw of 0.0394 and 0.0991, respectively. The crystal structure of the complex indicates a distorted octahedral environment around the Cu(II) atom, coordinated by four imidazole N atoms of four cbIm and two O atoms of two nitrates. Magnetic measurements show that the complex exhibits Curie behavior. 相似文献
16.
《Journal of Coordination Chemistry》2012,65(20):2197-2205
Reactions of Cd(NO3)2?·?4H2O with NH4SCN, ppz (ppz?=?piperazine) and bpa (bpa?=?bis(4-pyridyl)ethane) in CH3OH afforded the cavity-containing rectangular grids {Cd(SCN)2(ppz)} n (1) and {Cd(NCS)2(bpa)} n (2). The ppz ligand in 1 is coordinated to the metal through both nitrogen atoms to form the 1-D zig-zag chain structure and distorted {CdN4S2} octahedral coordination geometry at each Cd center is completed by pairs of bidentate thiocyanato ligands. Complex 2 has the 2-D arrangement constructed through 1-D double μ(N,S) end-to-end bridging thiocyanato groups bridging Cd(II) chains interconnected through disordered bpa ligands. 相似文献
17.
Smita Satapathi Subhasis Roy Kishalay Bhar Rajarshi Ghosh A. Srinivasa Rao Barindra K. Ghosh 《Structural chemistry》2011,22(3):605-613
Two binuclear cadmium(II) iodide compounds of the types [Cd2(L1)(I)4] (1) and [(L2)Cd(μ-I)CdI3] (2) [L1 = N,N′-(bis(pyridine-2-yl)formylidene)triethylenetetramine and L2 = tris(2-aminoethyl)amine] are synthesized and characterized.
X-ray structural study shows that each cadmium(II) in 1 has a distorted square pyramidal geometry with a CdN3I2 chromophore and that L1 behaves as a binucleating bis(tridentate) ligand bridging the metal centers with iodides remaining
as terminals. In 2, one cadmium(II) adopts a distorted tetrahedral geometry with a CdI4 chromophore surrounded by four iodides, while the other has a distorted trigonal bipyramidal environment with CdN4I chromophore bound by four N atoms of L2 and one bridging iodide. Weak C–H···π interactions in 1 result in an infinite 1D chain; however, such weak non-covalent interactions are absent in 2. The Schiff base complex, 1, shows high-energy intraligand 1(π–π*) fluorescence in DMF solution at room temperature, whereas compound 2 containing tripodal amine is fluorescent-inactive. 相似文献
18.
Gordana Pavlovi Zora Popovi
eljka Soldin Dubravka Matkovi‐alogovi 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(7):801-803
The reaction of 1‐methyl‐1,3‐imidazole‐2‐thione (meimtH) with mercury(II) iodide in methanol in a 2:1 molar ratio resulted in the formation of single crystals of the title compound, [HgI2(C4H6N2S)2]. The Hg atom is coordinated by two I [2.7809 (9) and 2.7999 (8) Å] and two thione S atoms [2.520 (3) and 2.576 (3) Å] with irregular tetrahedral coordination geometry. The NH groups of the imidazole ring take part in intra‐ and intermolecular hydrogen bonds with I atoms [N?I 3.596 (8) and 3.611 (9) Å, respectively] joining molecules into infinite chains parallel to the z axis. 相似文献
19.
《Journal of Coordination Chemistry》2012,65(6):671-680
The crystal and molecular structures of Ni(II) complexes with two tridentate anthracene-containing Schiff bases are reported. The Schiff bases were prepared by condensation of 9-anthraldehyde with diethylenetriamine (adien) and with dipropylenetriamine (adipn). Complexes synthesized from Ni(O2CCH3)2·4H2O and the ligands (1?:?1 mol ratio) crystallize from methanol as [Ni(adien)(O2CCH3)2(H2O)] (1) and [Ni(adipn)(O2CCH3)2]·2CH3OH (2·2CH3OH) in space groups P21/n and P212121, respectively. In 1, the distorted octahedral N3O3 coordination sphere around the metal ion is formed by the meridional N3-donor adien, two mutually trans unidentate acetates and one water molecule. The N3O3 coordination sphere constituted by the N3-donor adipn, one unidentate acetate and one bidentate acetate in 2 can be best described as trigonal bipyramidal. The secondary amine-N of adipn, the O-atom of the unidentate acetate and the midpoint of the two O-atoms of the bidentate acetate occupy the three equatorial positions and two imine-N atoms of adipn lie in axial sites. In the crystal lattice, molecules of 1 exist as discrete dimers due to intermolecular hydrogen bonding and π–π interactions. In contrast, self-assembly of 2 via intermolecular π–π interactions leads to a one-dimensional supramolecular structure. 相似文献
20.
Xia Yin Song‐Liang Cai Sheng‐Run Zheng Jun Fan Wei‐Guang Zhang 《Acta Crystallographica. Section C, Structural Chemistry》2012,68(7):m177-m180
The title compound, poly[aqua(μ2‐1H‐imidazole‐4‐carboxylato‐κ3N3,O:O′)hemi(μ2‐oxalato‐κ4O1,O2:O1′,O2′)cadmium(II)], [Cd(C4H3N2O2)(C2O4)0.5(H2O)]n, exhibits a two‐dimensional network. The CdII cation is coordinated to one N atom and two carboxylate O atoms from two 1H‐imidazole‐4‐carboxylate (Himc) ligands, two carboxylate O atoms from the bridging oxalate anion and one ligated water molecule; these six donor atoms form a distorted octahedral configuration. The oxalate anion lies on a centre of inversion. The Himc ligands connect the CdII cations to form –Cd–Himc–Cd–Himc–Cd– zigzag chains, with a Cd...Cd separation of 5.8206 (6) Å along the b direction, which are further linked by tetradentate oxalate anions to generate a two‐dimensional herringbone architecture in the ab plane. These layers are extended to form a three‐dimensional supramolecular framework via O—H...O and N—H...O hydrogen bonds and π–π stacking interactions. The solid‐state photoluminscent behaviour of the title compound has been investigated at room temperature. 相似文献