{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,11,24]],"date-time":"2025-11-24T09:47:47Z","timestamp":1763977667624},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"7","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Crystal Growth & Design"],"published-print":{"date-parts":[[2009,7,1]]},"DOI":"10.1021\/cg900334w","type":"journal-article","created":{"date-parts":[[2009,6,8]],"date-time":"2009-06-08T12:19:37Z","timestamp":1244463577000},"page":"3006-3010","source":"Crossref","is-referenced-by-count":66,"title":["Engineering Coordination and Supramolecular Copper\u2212Organic Networks by Aqueous Medium Self-Assembly with 1,3,5-Triaza-7-phosphaadamantane (PTA)"],"prefix":"10.1021","volume":"9","author":[{"given":"\u0141ukasz","family":"Jaremko","sequence":"first","affiliation":[{"name":"Centro de Qu\u00edmica Estrutural, Complexo I, Instituto Superior T\u00e9cnico, TU Lisbon, Av. Rovisco Pais, 1049-001 Lisbon, Portugal, College of Inter-Faculty Individual Studies in Mathematics and Natural Sciences, Warsaw University, ul. \u017bwirki i Wigury 93, 02-089 Warsaw, Poland, and Faculty of Chemistry, University of Wroc\u0142aw, 50-383, ul. F. Joliot-Curie 14, Wroclaw, Poland"}]},{"given":"Alexander M.","family":"Kirillov","sequence":"additional","affiliation":[{"name":"Centro de Qu\u00edmica Estrutural, Complexo I, Instituto Superior T\u00e9cnico, TU Lisbon, Av. Rovisco Pais, 1049-001 Lisbon, Portugal, College of Inter-Faculty Individual Studies in Mathematics and Natural Sciences, Warsaw University, ul. \u017bwirki i Wigury 93, 02-089 Warsaw, Poland, and Faculty of Chemistry, University of Wroc\u0142aw, 50-383, ul. F. Joliot-Curie 14, Wroclaw, Poland"}]},{"given":"Piotr","family":"Smole\u0144ski","sequence":"additional","affiliation":[{"name":"Centro de Qu\u00edmica Estrutural, Complexo I, Instituto Superior T\u00e9cnico, TU Lisbon, Av. Rovisco Pais, 1049-001 Lisbon, Portugal, College of Inter-Faculty Individual Studies in Mathematics and Natural Sciences, Warsaw University, ul. \u017bwirki i Wigury 93, 02-089 Warsaw, Poland, and Faculty of Chemistry, University of Wroc\u0142aw, 50-383, ul. F. Joliot-Curie 14, Wroclaw, Poland"}]},{"given":"Armando J. L.","family":"Pombeiro","sequence":"additional","affiliation":[{"name":"Centro de Qu\u00edmica Estrutural, Complexo I, Instituto Superior T\u00e9cnico, TU Lisbon, Av. Rovisco Pais, 1049-001 Lisbon, Portugal, College of Inter-Faculty Individual Studies in Mathematics and Natural Sciences, Warsaw University, ul. \u017bwirki i Wigury 93, 02-089 Warsaw, Poland, and Faculty of Chemistry, University of Wroc\u0142aw, 50-383, ul. F. Joliot-Curie 14, Wroclaw, Poland"}]}],"member":"316","published-online":{"date-parts":[[2009,6,8]]},"reference":[{"key":"ref1\/cit1a","volume-title":"Coordination Polymers: Design, Analysis and Application","author":"Batten S. 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Chem."},{"key":"ref7\/cit7c","doi-asserted-by":"crossref","first-page":"2922","DOI":"10.1021\/ic702373b","volume":"47","author":"Jaremko \u0141","year":"2008","journal-title":"Inorg. Chem."},{"key":"ref7\/cit7d","doi-asserted-by":"crossref","first-page":"1181","DOI":"10.1002\/ejic.200801023","author":"Smole\u0144ski P.","year":"2009","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref8\/cit8a","doi-asserted-by":"crossref","first-page":"2568","DOI":"10.1002\/anie.200462790","volume":"44","author":"Lidrissi C.","year":"2005","journal-title":"Angew. Chem., Int. Ed."},{"key":"ref8\/cit8b","doi-asserted-by":"crossref","first-page":"8665","DOI":"10.1002\/anie.200803232","volume":"47","author":"Serrano-Ruiz M.","year":"2008","journal-title":"Angew. Chem., Int. Ed."},{"key":"ref8\/cit8c","doi-asserted-by":"crossref","first-page":"1683","DOI":"10.1021\/om801026a","volume":"28","author":"Kirillov A. 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Chem."},{"key":"ref10\/cit10d","doi-asserted-by":"crossref","first-page":"1190","DOI":"10.1016\/j.jinorgbio.2007.11.007","volume":"102","author":"Karabach Y. Y.","year":"2008","journal-title":"J. Inorg. Biochem."},{"key":"ref10\/cit10e","doi-asserted-by":"crossref","first-page":"1728","DOI":"10.1016\/j.ica.2006.12.016","volume":"361","author":"Kirillova M. V.","year":"2008","journal-title":"Inorg. Chim. Acta"},{"key":"ref10\/cit10f","doi-asserted-by":"crossref","first-page":"162","DOI":"10.1021\/ic701669x","volume":"47","author":"Kirillov A. M.","year":"2008","journal-title":"Inorg. Chem."},{"key":"ref10\/cit10g","doi-asserted-by":"crossref","first-page":"2200","DOI":"10.1021\/cg060310e","volume":"6","author":"Karabach Y. Y.","year":"2006","journal-title":"Cryst. Growth Des."},{"key":"ref10\/cit10h","doi-asserted-by":"crossref","first-page":"506","DOI":"10.1016\/j.ica.2006.07.087","volume":"360","author":"Kirillova M. V.","year":"2007","journal-title":"Inorg. Chim. Acta"},{"key":"ref10\/cit10i","doi-asserted-by":"crossref","first-page":"4345","DOI":"10.1002\/anie.200500585","volume":"44","author":"Kirillov A. M.","year":"2005","journal-title":"Angew. Chem., Int. Ed."},{"key":"ref11\/cit11a","doi-asserted-by":"crossref","first-page":"2686","DOI":"10.1002\/ejic.200601152","author":"Kirillov A. M.","year":"2007","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref11\/cit11b","doi-asserted-by":"crossref","first-page":"1645","DOI":"10.1016\/j.ica.2008.07.016","volume":"362","author":"Jaremko \u0141","year":"2009","journal-title":"Inorg. Chim. Acta"},{"key":"ref12\/cit12","unstructured":"Synthesis and analytical data of1\u22123: To an aqueous solution (5 mL) of Cu(NO3)2\u00b72.5H2O (23 mg, 0.10 mmol) in HNO3(0.02 M, 0.10 mmol) (the acid was added to avoid a spontaneous hydrolysis of the metal salt) was added slowly an aqueous solution (5 mL) containing PTA (63 mg, 0.40 mmol) and the auxiliary ligand [sodium azide (26 mg, 0.40 mmol) for1; or sodium iodide (60 mg, 0.40 mmol) for2] with continuous stirring in air at room temperature. After being stirred for 15 min, the resulting cloudy solution was filtered off and the filtrate was left to evaporate in a beaker at ambient temperature. Colorless crystals (including those of X-ray quality) were formed in 1\u22122 weeks, then collected and dried in air to give compounds1and2in ca. 70% yield, based on copper(II) nitrate. Compound3was obtained (ca. 60% yield) by following the above procedure for1and2, but (i) starting from a non-acidic Cu(NO3)2solution and (ii) without using any auxiliary ligand. All characterization procedures of1\u22123were performed on the instruments and according to the techniques previously described.(7c, 8c)Analytical data for1: compound is slightly soluble in H2O (S25\u00b0C\u2248 5 mg\u00b7mL\u22121) and insoluble in common organic solvents. C6H12CuN6P (262.7): calcd. C 27.43, N 31.99, H 4.60; found: C 27.40, N 31.87, H 4.61. IR (KBr): 2957 (w), 2932 (w) and 2916 (w) \u03bd(CH), 2047 (vs br.) \u03bdas(N3), 1469 (w), 1440 (w), 1415 (m), 1360 (w), 1324 (w), 1282 (m), 1279 (m), 1239 (s), 1103 (s), 1091 (m), 1019 (s), 969 (s), 944 (s), 891 (m), 811 (s), 793 (s), 755 (s), 723 (m), 605 (s), 574 (s), 567 (s), 459 (w) and 442 (w) cm\u22121.1H NMR (300 MHz, D2O, Me4Si):\u03b4= 4.65 and 4.57 (J(HAHB) = 15 Hz, 12H, NCHAHBN), 4.15 (br. s, 12H, PCH2N) ppm.31P{1H} NMR (121.4 MHz, D2O, 85% H3PO4):\u03b4= \u221285.4 (br. s) ppm. Analytical data for2: compound is slightly soluble in H2O (S25\u00b0C\u2248 10 mg\u00b7mL\u22121), MeOH and EtOH; well soluble in DMSO. C18H40CuI3N9OP3(935.8): calcd. C 23.10, N 13.47, H 4.31; found: 22.91, N 13.08, 4.38. IR (KBr): 3467 (s br.) + 3370 (sh) \u03bd(H2O + NH), 2938 (w) and 2900 (w) \u03bd(CH), 1446 (m), 1403 (m), 1290 (s), 1252 (m), 1227 (s), 1111 (m), 1018 (s), 977 (s), 945 (s), 895 (s), 855 (s), 807 (m), 788 (m), 748 (s), 653 (w), 610 (s), 587 (m), 564 (s), 462 (s), 438 (m) and 414 (w) cm\u22121.1H NMR (300 MHz, DMSO-d6):\u03b4= 4.80 (br. s, 18H, NCH2N), 4.18 (br. s, 18H, PCH2N) ppm.31P{1H} NMR (121.4 MHz, DMSO-d6, 85% H3PO4):\u03b4= \u221284.4 (br. s) ppm. Analytical data for3: colorless crystalline solid, well soluble in H2O (S25\u00b0C\u2248 60 mg\u00b7mL\u22121), MeOH, EtOH, DMSO, and slightly soluble in Me2CO and THF. C24H60CuN13O9P4(862.3): calcd. C 33.43, N 21.12, H 7.01; found: 33.52, N 22.04, H 6.65. IR and NMR data are similar to those reported for [Cu(PTA)4]Cl\u00b76H2O(13)and [Cu(PTA)4](NO3)\u00b72H2O.(11a)"},{"key":"ref13\/cit13","first-page":"m603","volume":"64","author":"Kirillov A. M.","year":"2008","journal-title":"Acta Crystallogr."},{"key":"ref14\/cit14","unstructured":"Refinement details for the X-ray crystal structure analysis: Single crystals of1\u22123were mounted on a glass pin and transferred to an Oxford Xcalibur PX \u03ba geometry diffractometer. The collection and integration of crystal data were performed withCrysAlisCCDandCrysAlisREDsystems.15The structures were solved by direct methods with SHELXS-97 and refined using SHELXL-97.16All H atoms (apart from water H and amino H) were placed geometrically at idealized positions with C\u2212H distances of 0.97\u22120.99 \u00c5, and withUiso(H) values of 1.2Ueq(C). Water H atoms in2and3were found from difference Fourier map and refined isotropically withUiso(H) = 1.5Ueq(O) with the O\u2212H distances fixed to 0.85\u22120.88 \u00c5. In2the iodide anion was found to be disordered over three positions and refined with site occupancies of 0.36(1), 0.37(1), and 0.27(1). In3the NO3\u2212anion is disordered over multiple positions with oxygen atom site occupancies summing up to 3 and nitrogen atom to unity. The absorption correction was executed with CrysAlisRED15software givingTmin\/Tmaxof 0.751\/0.816, 0.432\/0.838 and 0.760\/0.811 for1,2, and3, respectively. Crystal data for1: C6H12CuN6P,M= 262.74, \u03bb = 0.71073 \u00c5 (Mo-K\u03b1),T= 100(2) K, monoclinic, space groupP21\/n,a= 6.543(3),b= 12.190(5),c= 12.043(5) \u00c5,\u03b2= 105.30(4)\u00b0,V= 926.5(7) \u00c53,Z= 4,Dc= 1.884 g\/cm3,F000= 536,\u03bc= 2.50 mm\u22121, 22496 reflections collected, 6307 independent, 3414 reflections withI> 2\u03c3(I) (Rint= 0.044),GOF= 0.908,R1 = 0.035,wR2= 0.085. Crystal data for2: C18H40CuI3N9OP3,M= 935.75, \u03bb = 0.71073 \u00c5 (Mo-K\u03b1),T= 100(2) K, monoclinic, space groupP21\/m,a= 6.505(2),b= 16.128(5),c= 13.913(4) \u00c5,\u03b2= 91.58(3)\u00b0,V= 1459.1(8) \u00c53,Z= 2,Dc= 2.130 g\/cm3,F000= 904,\u03bc= 4.12 mm\u22121, 36890 reflections collected, 10273 independent, 5509 reflections withI> 2\u03c3(I) (Rint= 0.057), GOF = 0.817,R1 = 0.033,wR2= 0.056. Crystal data for3: C24H60CuN13O9P4,M= 862.28, \u03bb = 0.71073 \u00c5 (Mo-K\u03b1),T= 220(2) K, cubic, space groupFd3m,a= 20.117(4) \u00c5,V= 8141(3) \u00c53,Z= 8,Dc= 1.407 g\/cm3,F000= 3648,\u03bc= 0.76 mm\u22121, 24920 reflections collected, 854 independent, 552 reflections withI> 2\u03c3(I) (Rint= 0.038), GOF = 1.006,R1 = 0.042,wR2= 0.118."},{"key":"ref15\/cit15","volume-title":"Oxford Diffraction. CrysAlis CCD and CrysAlis RED, Versions 1.171","year":"2003"},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"112","DOI":"10.1107\/S0108767307043930","volume":"64","author":"Sheldrick G. M.","year":"2008","journal-title":"Acta Crystallogr."}],"container-title":["Crystal Growth & Design"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/cg900334w","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,3,5]],"date-time":"2023-03-05T16:22:03Z","timestamp":1678033323000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/cg900334w"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2009,6,8]]},"references-count":51,"journal-issue":{"issue":"7","published-print":{"date-parts":[[2009,7,1]]}},"alternative-id":["10.1021\/cg900334w"],"URL":"https:\/\/doi.org\/10.1021\/cg900334w","relation":{},"ISSN":["1528-7483","1528-7505"],"issn-type":[{"value":"1528-7483","type":"print"},{"value":"1528-7505","type":"electronic"}],"subject":[],"published":{"date-parts":[[2009,6,8]]}}}