Crystallography Open Database

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Searching year of publication is 2015

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1517967 CIFC40 H48 Cl4 Ni O4 P2P 1 21/n 110.1261; 23.4579; 17.8192
90; 106.355; 90
4061.4Hwang, Seung Jun; Powers, David C.; Maher, Andrew G.; Nocera, Daniel G.
Tandem redox mediator/Ni(ii) trihalide complex photocycle for hydrogen evolution from HCl
Chem. Sci., 2015, 6, 917
1517970 CIFC12 H12 Au Br2 N OP -17.0801; 10.0993; 10.1771
97.689; 99.69; 92.96
708.82Wu, Qian; Du, Chenglong; Huang, Yumin; Liu, Xingyan; Long, Zhen; Song, Feijie; You, Jingsong
Stoichiometric to catalytic reactivity of the aryl cycloaurated species with arylboronic acids: insight into the mechanism of gold-catalyzed oxidative C(sp2)‒H arylation
Chem. Sci., 2015, 6, 288
1517971 CIFC18 H15 Au Br NP b c a15.9554; 11.7205; 16.839
90; 90; 90
3148.98Wu, Qian; Du, Chenglong; Huang, Yumin; Liu, Xingyan; Long, Zhen; Song, Feijie; You, Jingsong
Stoichiometric to catalytic reactivity of the aryl cycloaurated species with arylboronic acids: insight into the mechanism of gold-catalyzed oxidative C(sp2)‒H arylation
Chem. Sci., 2015, 6, 288
1517972 CIFC18 H16 Au Cl2 NP -17.8572; 8.2744; 15.3789
93.413; 103.381; 113.776
876.93Wu, Qian; Du, Chenglong; Huang, Yumin; Liu, Xingyan; Long, Zhen; Song, Feijie; You, Jingsong
Stoichiometric to catalytic reactivity of the aryl cycloaurated species with arylboronic acids: insight into the mechanism of gold-catalyzed oxidative C(sp2)‒H arylation
Chem. Sci., 2015, 6, 288
1517979 CIFC19 H16 N2 O3P 1 21 16.8436; 26.8023; 8.3932
90; 90.9; 90
1539.33Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur
The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures
Chem. Sci., 2015, 6, 457
1517980 CIFC19 H16 N2 O3P 1 21 16.8507; 26.777; 8.4103
90; 90.84; 90
1542.63Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur
The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures
Chem. Sci., 2015, 6, 457
1517981 CIFC26 H22 N2 O3P 1 21 15.4249; 16.5948; 11.417
90; 98.277; 90
1017.11Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur
The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures
Chem. Sci., 2015, 6, 457
1517982 CIFC26 H22 N2 O3P 1 21 15.4288; 16.6067; 11.4114
90; 98.2867; 90
1018.05Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur
The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures
Chem. Sci., 2015, 6, 457
1517983 CIFC57 H49.5 Eu N6 O11.5C 2 2 2126.0015; 26.4029; 30.8305
90; 90; 90
21165.6Kotova, Oxana; Blasco, Salvador; Twamley, Brendan; O'Brien, John; Peacock, Robert D.; Kitchen, Jonathan A.; Martínez-Calvo, Miguel; Gunnlaugsson, Thorfinnur
The application of chiroptical spectroscopy (circular dichroism) in quantifying binding events in lanthanide directed synthesis of chiral luminescent self-assembly structures
Chem. Sci., 2015, 6, 457
1517990 CIFC197.82 H137.82 Cl5.46C 1 2 153.108; 21.244; 26.197
90; 98.53; 90
29229Matsuno, Taisuke; Sato, Sota; Iizuka, Ryosuke; Isobe, Hiroyuki
Molecular recognition in curved π-systems: effects of π-lengthening of tubular molecules on thermodynamics and structures
Chem. Sci., 2015, 6, 909
1518019 CIFC36 H66 Al Cl5 P2 Pb PtP c a 2125.2527; 13.9068; 24.7327
90; 90; 90
8685.7Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518020 CIFC120 H156 B2 Cl18 P4 Pb2 Pt2P -110.5092; 15.3892; 20.0776
109.785; 90.439; 90.796
3054.9Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518021 CIFC36 H66 Al Cl4 I P2 Pb PtP -113.381; 13.612; 13.987
92.698; 111.864; 101.984
2291Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518022 CIFC36 H66 Al2 Cl8 P2 Pb PtC 1 2/c 120.719; 10.6901; 23.859
90; 111.311; 90
4923.1Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518023 CIFC72 H132 Br2 P4 Pt2 SnP -113.9687; 14.2448; 21.1628
96.439; 101.9; 114.878
3643.1Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518024 CIFC36 H66 Al Br5 P2 Pt SnP -111.5394; 12.469; 17.7
105.191; 100.053; 107.994
2245.2Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518025 CIFC60 H78 B Br Cl8 P2 Pt SnP -113.5049; 15.4437; 15.6528
82.203; 78.913; 85.651
3169.9Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518026 CIFC36 H66 Al2 Br8 P2 Pt SnP 1 21/n 113.2989; 22.907; 16.964
90; 99.008; 90
5104.1Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518027 CIFC56 H110 Br3 N O P2 Pt SnP -115.687; 20.715; 21.567
75.297; 82.231; 78.538
6617Braunschweig, Holger; Celik, Mehmet Ali; Dewhurst, Rian D.; Heid, Magdalena; Hupp, Florian; Sen, Sakya S.
Stepwise isolation of low-valent, low-coordinate Sn and Pb mono- and dications in the coordination sphere of platinum
Chem. Sci., 2015, 6, 425
1518028 CIFC36 H49.5 Cl F12 Fe Li2 N O6P -112.26; 12.5792; 15.8788
75.171; 71.664; 67.768
2125.4Pascualini, M. E.; Di Russo, N. V.; Thuijs, A. E.; Ozarowski, A.; Stoian, S. A.; Abboud, K. A.; Christou, G.; Veige, A. S.
A high-spin square-planar Fe(ii) complex stabilized by a trianionic pincer-type ligand and conclusive evidence for retention of geometry and spin state in solution
Chem. Sci., 2015, 6, 608
1518079 CIFC12 As2 F21 Se2P -18.5406; 8.5891; 14.093
84.9; 84.781; 88.091
1025.1Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518080 CIFC48 H50 S2P 1 21/n 115.695; 15.264; 16.274
90; 93.45; 90
3891.7Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518081 CIFC48 H50 F6 S2 SbP 1 21/n 116.17; 15.837; 17.339
90; 92.97; 90
4434.3Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518082 CIFC49 H52 Cl2 F6 Sb Se2P 1 21/c 119.147; 15.238; 16.653
90; 90.08; 90
4859Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518083 CIFC51 H55 F6 N Sb Te2C 1 2/c 119.854; 14.726; 17.178
90; 92.07; 90
5019Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518084 CIFC12 F21 S2 Sb2P 1 21/n 112.029; 12.276; 14.44
90; 97.662; 90
2113.3Mallow, Ole; Khanfar, Monther A.; Malischewski, Moritz; Finke, Pamela; Hesse, Malte; Lork, Enno; Augenstein, Timo; Breher, Frank; Harmer, Jeffrey R.; Vasilieva, Nadezhda V.; Zibarev, Andrey; Bogomyakov, Artem S.; Seppelt, Konrad; Beckmann, Jens
Diaryldichalcogenide radical cations
Chem. Sci., 2015, 6, 497
1518097 CIFC60 H78 Cl2 Ir N2 O6.5 P2 S2P -111.6106; 17.2668; 18.6161
113.198; 95.475; 105.211
3226Oldenhof, Sander; Lutz, Martin; de Bruin, Bas; Ivar van der Vlugt, Jarl; Reek, Joost N. H.
Dehydrogenation of formic acid by Ir‒bisMETAMORPhos complexes: experimental and computational insight into the role of a cooperative ligand
Chem. Sci., 2015, 6, 1027
1518098 CIFC30 H25 N O4P -112.1231; 12.9429; 17.2915
95.734; 108.021; 113.144
2295Berger, Reinhard; Wagner, Manfred; Feng, Xinliang; Müllen, Klaus
Polycyclic aromatic azomethine ylides: a unique entry to extended polycyclic heteroaromatics
Chem. Sci., 2015, 6, 436
1518099 CIFC38.5 H20 Cl F10 NP -112.6166; 16.35; 16.738
87.227; 75.478; 67.501
3083.7Berger, Reinhard; Wagner, Manfred; Feng, Xinliang; Müllen, Klaus
Polycyclic aromatic azomethine ylides: a unique entry to extended polycyclic heteroaromatics
Chem. Sci., 2015, 6, 436
1518122 CIFC28 H39 Br O4P 1 21/c 19.3571; 16.7917; 17.242
90; 101.238; 90
2657.1Ghiggino, Kenneth P.; Tilley, Andrew J.; Robotham, Benjamin; White, Jonathan M.
Excited state dynamics of organic semi-conducting materials.
Faraday discussions, 2015, 177, 111-119
1518139 CIFC40 H60 Cu3 K N8 O54 Ru Si W11P -4 21 m24.415; 24.415; 15.337
90; 90; 90
9142Shi, Dongying; He, Cheng; Qi, Bo; Chen, Cong; Niu, Jingyang; Duan, Chunying
Merging of the photocatalysis and copper catalysis in metal‒organic frameworks for oxidative C‒C bond formation
Chem. Sci., 2015, 6, 1035
1518140 CIFC40 H58 Cu2 K N8 O52 Ru Si W11P c c n17.8663; 22.1923; 22.2835
90; 90; 90
8835.3Shi, Dongying; He, Cheng; Qi, Bo; Chen, Cong; Niu, Jingyang; Duan, Chunying
Merging of the photocatalysis and copper catalysis in metal‒organic frameworks for oxidative C‒C bond formation
Chem. Sci., 2015, 6, 1035
1518141 CIFC13 H14 N2 O2P 1 21/c 111.6434; 10.03245; 20.857
90; 103.161; 90
2372.35Brachet, E.; Ghosh, T.; Ghosh, I.; König, B.
Visible light C‒H amidation of heteroarenes with benzoyl azides
Chem. Sci., 2015, 6, 987
1518142 CIFC13 H10 N2 O4P 1 21/n 18.3156; 9.9732; 14.574
90; 102.762; 90
1178.81Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518143 CIFC13 H9 N2 O4P 1 21 18.3745; 10.0838; 14.5833
90; 103.496; 90
1197.51Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518144 CIFC13 H9 F N2 O4P 1 21/c 17.24677; 14.8112; 11.0943
90; 99.3083; 90
1175.11Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518145 CIFC13 H9 F N2 O4P 1 21 17.1667; 5.2718; 15.7374
90; 101.26; 90
583.14Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518146 CIFC13 H9 F N2 O4P 1 21 17.1322; 5.2282; 15.7662
90; 101.237; 90
576.63Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518147 CIFC13 H9 F N2 O4P 21 21 216.56098; 13.5445; 13.6122
90; 90; 90
1209.65Maeno, Mayaka; Tokunaga, Etsuko; Yamamoto, Takeshi; Suzuki, Toshiya; Ogino, Yoshiyuki; Ito, Emi; Shiro, Motoo; Asahi, Toru; Shibata, Norio
Self-disproportionation of enantiomers of thalidomide and its fluorinated analogue via gravity-driven achiral chromatography: mechanistic rationale and implications
Chem. Sci., 2015, 6, 1043
1518148 CIFC12 H40 B4 N4 O6P 1 21/n 116.026; 8.7017; 17.485
90; 115.469; 90
2201.4Kalviri, Hassan A.; Gärtner, Felix; Ye, Gang; Korobkov, Ilia; Baker, R. Tom
Probing the second dehydrogenation step in ammonia-borane dehydrocoupling: characterization and reactivity of the key intermediate, B-(cyclotriborazanyl)amine-borane
Chem. Sci., 2015, 6, 618
1518149 CIFC4 H26 B4 N4 O2P -16.9419; 8.8077; 12.4471
91.79; 103.761; 111.731
680.64Kalviri, Hassan A.; Gärtner, Felix; Ye, Gang; Korobkov, Ilia; Baker, R. Tom
Probing the second dehydrogenation step in ammonia-borane dehydrocoupling: characterization and reactivity of the key intermediate, B-(cyclotriborazanyl)amine-borane
Chem. Sci., 2015, 6, 618
1518154 CIFC22 H22.5 B Cl Cr F4 N4.5 O3P b c n14.5572; 13.9044; 24.0822
90; 90; 90
4874.5Kotani, Hiroaki; Kaida, Suzue; Ishizuka, Tomoya; Sakaguchi, Miyuki; Ogura, Takashi; Shiota, Yoshihito; Yoshizawa, Kazunari; Kojima, Takahiko
Formation and characterization of a reactive chromium(v)‒oxo complex: mechanistic insight into hydrogen-atom transfer reactions
Chem. Sci., 2015, 6, 945
1518155 CIFC21 H20 B2 Cr F8 N5 O2P 1 21/c 19.683; 22.83; 11.317
90; 104.712; 90
2419.7Kotani, Hiroaki; Kaida, Suzue; Ishizuka, Tomoya; Sakaguchi, Miyuki; Ogura, Takashi; Shiota, Yoshihito; Yoshizawa, Kazunari; Kojima, Takahiko
Formation and characterization of a reactive chromium(v)‒oxo complex: mechanistic insight into hydrogen-atom transfer reactions
Chem. Sci., 2015, 6, 945
1518167 CIFC51 H99 K N2 O6 Si6 ThP -112.1595; 12.7622; 22.2587
100.93; 104.448; 95.5814
3246.1Langeslay, Ryan R.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.
Synthesis, structure, and reactivity of crystalline molecular complexes of the {[C5H3(SiMe3)2]3Th}1−anion containing thorium in the formal +2 oxidation state
Chem. Sci., 2015, 6, 517
1518168 CIFC53 H103 K O8 Si6 ThP 1 21/n 117.1884; 18.0161; 22.654
90; 99.6558; 90
6915.8Langeslay, Ryan R.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.
Synthesis, structure, and reactivity of crystalline molecular complexes of the {[C5H3(SiMe3)2]3Th}1−anion containing thorium in the formal +2 oxidation state
Chem. Sci., 2015, 6, 517
1518169 CIFC33 H63 Si6 ThP 1 21/c 117.547; 13.6955; 19.1293
90; 112.595; 90
4244.2Langeslay, Ryan R.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.
Synthesis, structure, and reactivity of crystalline molecular complexes of the {[C5H3(SiMe3)2]3Th}1−anion containing thorium in the formal +2 oxidation state
Chem. Sci., 2015, 6, 517
1518170 CIFC30 H50 Si4 ThC 1 2/c 120.2007; 8.1694; 19.9544
90; 91.3531; 90
3292.1Langeslay, Ryan R.; Fieser, Megan E.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.
Synthesis, structure, and reactivity of crystalline molecular complexes of the {[C5H3(SiMe3)2]3Th}1−anion containing thorium in the formal +2 oxidation state
Chem. Sci., 2015, 6, 517
1518200 CIFC28 H20 N4P -17.8497; 10.7861; 14.7876
109.56; 91.8983; 111.312
1081.87Rijeesh, K.; Hashim, P. K.; Noro, Shin-ichiro; Tamaoki, Nobuyuki
Dynamic induction of enantiomeric excess from a prochiral azobenzene dimer under circularly polarized light
Chem. Sci., 2015, 6, 973
1518209 CIFC11 H7 Au Cl2 F NP 1 21/c 19.1445; 7.8648; 15.71
90; 106.294; 90
1084.5Maity, Ayan; Sulicz, Amanda N.; Deligonul, Nihal; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.
Suzuki‒Miyaura coupling of arylboronic acids to gold(iii)
Chem. Sci., 2015, 6, 981
1518210 CIFC24 H18 Au F2 NP -114.8527; 16.3867; 17.62
90.156; 91.414; 114.256
3908.3Maity, Ayan; Sulicz, Amanda N.; Deligonul, Nihal; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.
Suzuki‒Miyaura coupling of arylboronic acids to gold(iii)
Chem. Sci., 2015, 6, 981

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