Zarife Sibel ŞAHİN, Ömer YURDAKUL, Dursun Ali KÖSE, Zeynel ÖZTÜRK

The Structural and Thermal Characterization of New Cu-Arginate Complex; Experimental and Simulated Hydrogen Adsorbstion Properties

The copper-arginate complex was synthesized and characterized by using FTIR, TG/DTA-DrTG, UV-Vis spectroscopy and elemental analysis methods. In addition, experimental and theoretical hydrogen storage capabilities were investigated. The unit cell of complex structure included that one mole CuII as centered cation and one mole of free NaI cation and one mole of NaSO4- as coordinated to arginine ligand and two moles of arginate ligands and one mole of aqua ligand as coordinated to NaSO4-. The CuII cation had square-pyramidal coordination sphere and the Na1 metal cation had trigonal coordination scheme. The other sodium metal cation (Na2) was implemented in the released position as counter ion of NaSO4-. It was found that the arginine complex, synthesized in this work have 0.533 m2/g BET surface area and 6.92E-3 wt. % hydrogen storage capacity at 77 K and 1 bar while simulated value was 3.27E-3 wt. % for the same conditions.

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Cotton FA, Day VW, Hazen EEJr, Larsen S, Wong STK. Structure of bis(methylguanidinium) monohydrogen orthophosphate. Model for the arginine-phosphate interactions at the active site of staphylococcal nuclease and other phosphohydrolytic enzymes J. Am. Chem. Soc. 96 (1974) 4471-4478.
Patthy L, Smith EL. Reversible modification of arginine residues. Application to squence studies by restriction of tryptic hyrolysis to lysine residues. J. Biol. Chem. Soc. 250(2) (1975) 557-564.
Lippard SJ, Berg JM. Principles of bioinorganic chemistry, (University Science Books), Mill Valley, CA, 1994.
Stone DL, Smith DK, Whitwood AC. Copper aminoacid complexes-towards encapsulated metal centres. Polyhedron 23 (2004) 1709-1717.
Ohata N, Masuda H, Yamauchi O. Aromatic carboxylatecontrolled self-organization of copper(II)-l-arginine complexes. Inorg. Chim. Acta 286(1) (1999) 37-45.
Hamilton AD. Supramolecular control of structure and reactivity, Wiley, Chichester, 1996.
Stanila A, Marcu A, Rusu D, Rusu M, David L. Spectroscopic studies of some copper(II) complexes with amino acidsJ. Mol. Struc. 834-836 (2007) 364-368.
Iqbal MZ, Khurshid S, Iqbal MS. Antibacterial activity of copper-amino acid complexes. J. Pak. Med. Assoc. 40(9) (1990) 221-222.
Venelinov T, Arpadjan S, Karadjova I, Beattie. J. Properties of the copper(II)-histidine complex obtained after dialysis of human plasma with histidine. Acta Pharm. 56 (2006) 105- 112.
Sorensen JRJ, Sigel H. Metal Ions in Biological Systems, Marcel Dekker, New York, Vol. 14, p.77. 1982.
Kato M, Muto Y. Factors affecting the magnetic properties of dimeric copper(II) complexes. Coord. Chem. Rev. 92 (1988) 45-83.
Nagar R. Synthesis, spectral characterization and DNA bindings of tridentate N2O donor Schiff base metal(II) complexes. J. Inorg. Biochem. 40 (1990) 349-356.
Cavigiolio G, Benedetto L, Boccaleri E, Colangelo D, Viano I, Osella D. Pt(II) complexes with different N-donor aromatic ligands for specific inhibition of telomerase. Inorg. Chim. Acta 305 (2000) 61-68.
Öztürkkan EF, Köse DA, Necefoglu H, Uzun I. Synthesis and characterization of bis(N,N-diethylnicotin-amide) p-halogenobenzoate complexes of Co(II). Asian J. Chem. 19(6) (2007) 4880-4888.
Köse DA, Gökçe G, Gökçe S, Uzun I. bis(N,N- diethylnicotinamide) p-chlorobenzoate complexes of Ni(II), Zn(II) and Cd(II). J. Therm. Anal. Cal. 95(1) (2009) 247-251.
Köse DA, Ay AN, Şahin O, Büyükgüngör O. A mononuclear Zn(II) complex of mixed ligands with both fivefold- and sixfold- coordinations in the same framework J. Iran. Chem. Soc. 9(4) (2012) 591-597.
Köse DA, Necefoglu H, Sahin O, Büyükgüngör O. Synthesis, spectral, thermal and structural study of monoaquabis(acetylsalicylato-kO)bis(nicotinamide-kN) copper(II). J. Chem. Crystallogr. 41 (2011) 297-305
Köse DA, Zumreoglu-Karan B, Unaleroglu C, Sahin O, Buyukgungor O. Synthesis and characterization of transition metal-vitamin B13 complexes with a Co-vitamin. J. Coord. Chem. 789 (2006) 147-151.
Yaghi OM, Li H, Groy TL.Construction of porous solids from hydrogen-bonded metal complexes of 1,3,5-benzenetricarboxylic acid. J. Am. Chem. Soc. 118(38) (1996) 9096-9101.
Rosi NL, Eckert J, Eddaoudi M, Vodak DT, Kim J, O'Keeffe M, Yaghi OM. Hydrogen storage in microporous metal-organic frameworks. Science 300(5622) (2003) 1127-1129.
Seo JS, Whang D, Lee H, Im Jun S, Oh J, Jeon YJ, Kim K. A homochiral metal-organic porous material for enantioselective separation and catalysis. Nature 404(6781) (2000) 982-986.
Sagara T, Klassen J, Ganz E. Computational study of hydrogen binding by metal-organic framework-5. J. Chem. Phys. 121(24) (2004) 12543-12547.
Baykasoglu C, Ozturk Z, Kirca M, Celebi AT, Mugan A, To AC. Effects of lithium doping on hydrogen storage properties of heat welded random CNT network structures. Int. J. Hyd. Energy 2016, 41(19), 8246-8255.
Ozturk Z, Baykasoglu C, Kirca M. Sandwiched graphene- fullerene composite: A novel 3-D nanostructured material for hydrogen storage. Int. J. Hyd. Energy 41(15) (2016) 6403-6411.
Vlachy V, Ichiye T, Haymet ADJ. Symmetric associating electrolytes: GCMC simulations and integral equation theory. J. Am. Chem. Soc. 113(4) (1991) 1077-1082.
Pham T, Forrest KA, Hogan A, Tudor B, McLaughlin K, Belof JL, Eckert J, Space B. Understanding hydrogen sorption in In-soc-MOF: A charged metal-organic framework with open-metal sites, narrow channels, and counterions. Cryst. Growth & Design 15(3) (2015) 1460-1471.
Köse DA, Toprak E, Kaşarcı A, Avcı E, Avcı GA, Şahin O, Büyükgüngör O. Synthesis, spectral, thermal studies of Co(II), Ni(II), Cu(II) and Zn(II)-arginato complexes. Crystal structure of monoaquabis(arginato-kO, kN)copper(II). [Cu(arg)2(H2O)].NaNO, J. Chin. Chem. Soc. 61 (2014) 881- 890.
Ozturk Z, Kose DA, Asan A, Ozkan G. Porous metal-organic Cu(II) complex of L-Arginine; synthesis, characterization, hydrogen storage properties and molecular simulation calculations. Hittite J. Sci. & Eng. 1(1) (2014) 1-5.
Ozturk Z, Ozkan G, Kose DA, Asan A. Experimental and simulation study on structural characterization and hydrogen storage of metal organic structured compounds. Int. J. Hyd. Energy 41(19) (2016) 8256-8263.
Köse DA, Necefoglu H, Icbudak H. Synthesis and characterization of N,N-diethylnicotinamide- acetylsalicylato complexes of Co(II), Ni(II), Cu(II), and Zn(II). J. Coord. Chem. 61(21) (2008) 3508-3515.
Köse DA, Necefoglu H. Synthesis and characterization of bis(nicotinamide) m-hydroxybenzoate complexes of Co(II), Ni(II), Cu(II) and Zn(II). J. Therm. Anal. Cal. 93(2) (2008) 509-514.
Farrugia LJJ. WinGX suite for small-molecule single-crystal crystallography. Apply. Cryst. 32 (1999) 837-838.
Sheldrick GM. A short history of SHELX. Acta Cryst. A64 (2008) 112-122.
Mercury, version 3.0; CCDC, available online via ccdc.cam. ac.uk/products/mercury.
Spek AL. PLATON-a multipurpose crystallographic tool. Utrecht University, Utrecht (2005).
Addison AW, Rao TN, Reedijk J, Rijn JV, Verschoor GC. Synthesis, structure, and spectroscopic properties of copper(II) compounds containing nitrogen-sulphur donor ligands; the crystal and molecular structure of aqua[1,7- bis(N-methylbenzimidazol-2´-yl)-2,6-dithiaheptane] copper(II) perchlorate. J. Chem. Soc. Dalton Trans. (1984) 1349-1356.
Ohata N, Masuda H, Yamauchi O. Dianion-controlled supramolecular assembly of copper(II)-arginine complex ion. Inorg. Chim. Acta 749 (2000) 300-302.
Hemissi H, Nasri M, Abid S, Al-Deyab SS, Dhahri E, Hlil EK, Rzaigui M. Crystal structure, spectroscopic, magnetic and electronic structure studies of a novel Cu(II) amino acid complex [Cu(l-arg)2(H2O)]2(P4O12).8H2O. J. Solid State Chem. 196 (2012) 489-497.
Viera I, Torre MH, Piro OE, Castellano EE, Baran EJ. Structural and spectroscopic characterization of aqua- diargininate-copper(II)-carbonate monohydrate. J. Inorg. Biochem. 99(5) (2005) 1250-1254.
Zhou X, Yang C, Le X, Chen S, Liu J, Huang Z. Synthesis and crystal structures of one-dimensional ClO bridged coordination polymers: {[Cu(Bpy)2(?2-ClO4)].ClO4} n and {[Cu2(L-arg)2(Bpy)2(?2-ClO4)2].2ClO4·4H2O}n. J. Coord. Chem. 57(5) (2004) 401-409.
Santana RC, Carvalho JF, Vencato I, Napolitano HB, Bortoluzzi AJ, Barberis GE, Rapp RE, Passeggi MCG, Calvo R. Synthesis, crystal structure and magnetic properties of a new dinuclear copper(II) amino acid complex [Cu2(l-arg)2(?- HPO4-O)(?-HPO4-O,O')(?-OH)]-.(H3O)+.(H2O)6. Polyhedron 26(17) (2007) 5001-5008.
Hu R, Yu Q, Liang F, Ma L, Chen X, Zhang M, Liang H, Yu K. Syntheses and crystal structures of cis- and trans- copper(II) complexes of L-arginine. J. Coord. Chem. 61 (2008) 1265-1271.