Crystallography Open Database

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Searching year of publication is 2020

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1557262 CIFC21 H21 F O2P 1 21 16.512; 15.336; 8.7541
90; 111.502; 90
813.41Groves, Alistair; Sun, Jinwei; Parke, Hal R. I.; Callingham, Michael; Argent, Stephen P.; Taylor, Laurence J.; Lam, Hon Wai
Catalytic enantioselective arylative cyclizations of alkynyl 1,3-diketones by 1,4-rhodium(i) migration
Chemical Science, 2020, 11, 2759-2764
1557263 CIFC22 H22 O2P 21 21 219.5439; 10.5734; 17.3218
90; 90; 90
1747.97Groves, Alistair; Sun, Jinwei; Parke, Hal R. I.; Callingham, Michael; Argent, Stephen P.; Taylor, Laurence J.; Lam, Hon Wai
Catalytic enantioselective arylative cyclizations of alkynyl 1,3-diketones by 1,4-rhodium(i) migration
Chemical Science, 2020, 11, 2759-2764
1557264 CIF
HKL
Paper
C14 H27 F6 N O11 S2P 1 21 18.8341; 24.3932; 11.6111
90; 108.086; 90
2378.47Kitada, Atsushi; Funasako, Yusuke; Matsumoto, Kazuhiko; Hagiwara, Rika; Inokuchi, Makoto; Fukami, Kazuhiro; Murase, Kuniaki
Hydronium bis(trifluoromethanesulfonyl)amide‒18-crown-6 (1/1)
IUCrData, 2020, 5, x200162
1557268 CIFC33 H30 Cl2 N5 O6P -19.6678; 12.9865; 14.6942
64.386; 71.962; 85.754
1577.95Martin, Flavia; Pop, Mihaela; Kacso, Irina; Grosu, Ioana Georgeta; Miclaus, Maria; Vodnar, Dan; Lung, Ildiko; Filip, Gabriela Adriana; Olteanu, Elena Diana; Moldovan, Remus; Nagy, Andras; Filip, Xenia; Baldea, Ioana
Ketoconazole - p-aminobenzoic acid cocrystal: revival of an old drug by crystal engineering.
Molecular pharmaceutics, 2020
1557269 CIFC33 H30 Cl2 N5 O6P -19.7532; 13.0997; 14.7094
65.035; 72.196; 84.857
1620.45Martin, Flavia; Pop, Mihaela; Kacso, Irina; Grosu, Ioana Georgeta; Miclaus, Maria; Vodnar, Dan; Lung, Ildiko; Filip, Gabriela Adriana; Olteanu, Elena Diana; Moldovan, Remus; Nagy, Andras; Filip, Xenia; Baldea, Ioana
Ketoconazole - p-aminobenzoic acid cocrystal: revival of an old drug by crystal engineering.
Molecular pharmaceutics, 2020
1557270 CIFC17 H30 Cl2 Co N3 O3 PP 1 21/c 116.5582; 8.7009; 16.729
90; 111.858; 90
2236.9Xu, Yuechao; Zhao, Junyi; Gan, Qiao; Ying, Weilun; Hu, Zhonghan; Tang, Fuming; Luo, Wanwei; Luo, Yunjie; Jian, Zhongbao; Gong, Dirong
Synthesis and properties investigation of hydroxyl functionalized polyisoprene prepared by cobalt catalyzed co-polymerization of isoprene and hydroxylmyrcene
Polymer Chemistry, 2020, 11, 2034-2043
1557271 CIFC108 H154 N18 O27P 1 21 113.959; 25.347; 18.606
90; 109.574; 90
6202.7Zhou, Bin; Shetye, Gauri; Yu, Yang; Santarsiero, Bernard D.; Klein, Larry L.; Abad-Zapatero, Cele; Wolf, Nina M.; Cheng, Jinhua; Jin, Yingyu; Lee, Hanki; Suh, Joo-Won; Lee, Hyun; Bisson, Jonathan; McAlpine, James B.; Chen, Shao-Nong; Cho, Sang-Hyun; Franzblau, Scott G.; Pauli, Guido F.
Antimycobacterial Rufomycin Analogues from <i>Streptomyces atratus</i> Strain MJM3502.
Journal of natural products, 2020
1557272 CIFC35 H40 O12P 18.505; 9.1711; 10.7701
100.159; 99.818; 90.932
813.86Fu, Yifan; Zhao, Weimin
Polyesterified Sesquiterpenoids from the Seeds of <i>Celastrus paniculatus</i> as Lifespan-Extending Agents for the Nematode <i>Caenorhabditis elegans</i>.
Journal of natural products, 2020, 83, 505-515
1557278 CIFC55 H68 D3 Eu N2 O6P 1 21/c 112.3206; 27.4776; 17.5732
90; 104.527; 90
5759Fishman, Natalya N.; Lukzen, Nikita N.; Ivanov, Konstantin L.; Edeleva, Mariya V.; Fokin, Sergey V.; Romanenko, Galina V.; Ovcharenko, Victor I.
Multifrequency NMR as an Efficient Tool to Investigate Heterospin Complexes in Solutions.
The journal of physical chemistry. A, 2020
1557279 CIFC24 H20 Dy N9 O9P 1 21/n 116.4862; 10.4198; 18.1346
90; 111.576; 90
2896.9Wang, Hui-Feng; Ma, Xiong-Feng; Zhu, Zhong-Hong; Zou, Hua-Hong; Liang, Fu-Pei
Regulation of the Metal Center and Coordinating Anion of Mononuclear Ln(III) Complexes to Promote an Efficient Luminescence Response to Various Organic Solvents
Langmuir, 2020
1557280 CIFC27 H29 Dy N10 O6 SP 1 21/n 112.249; 10.064; 26.264
90; 90.684; 90
3237Wang, Hui-Feng; Ma, Xiong-Feng; Zhu, Zhong-Hong; Zou, Hua-Hong; Liang, Fu-Pei
Regulation of the Metal Center and Coordinating Anion of Mononuclear Ln(III) Complexes to Promote an Efficient Luminescence Response to Various Organic Solvents
Langmuir, 2020
1557281 CIFC24 H16.5 Eu N9 O9P 1 21/n 116.8934; 10.4286; 17.9567
90; 110.828; 90
2956.8Wang, Hui-Feng; Ma, Xiong-Feng; Zhu, Zhong-Hong; Zou, Hua-Hong; Liang, Fu-Pei
Regulation of the Metal Center and Coordinating Anion of Mononuclear Ln(III) Complexes to Promote an Efficient Luminescence Response to Various Organic Solvents
Langmuir, 2020
1557282 CIFC24 H21 N9 O9 TbP 1 21/n 116.6874; 10.4401; 18.036
90; 111.134; 90
2930.9Wang, Hui-Feng; Ma, Xiong-Feng; Zhu, Zhong-Hong; Zou, Hua-Hong; Liang, Fu-Pei
Regulation of the Metal Center and Coordinating Anion of Mononuclear Ln(III) Complexes to Promote an Efficient Luminescence Response to Various Organic Solvents
Langmuir, 2020
1557283 CIFC25 H30 N4 O3P -16.6601; 7.4588; 23.5097
94.931; 90.774; 105.499
1120.43Shi, Xiujuan; Yan, Neng; Niu, Guangle; Sung, Simon H. P.; Liu, Zhiyang; Liu, Junkai; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Wang, Wen-Xiong; Sung, Herman H.-Y.; Williams, Ian D.; Tang, Ben Zhong
In vivo monitoring of tissue regeneration using a ratiometric lysosomal AIE probe
Chemical Science, 2020, 11, 3152-3163
1557284 CIFC60 H44 Mn4 N12 O52 Si W12C 1 2/c 124.8686; 23.1581; 17.7369
90; 98.907; 90
10091.7Du, Jing; Lang, Zhong-Ling; Ma, Yuan-Yuan; Tan, Hua-Qiao; Liu, Bai-Ling; Wang, Yong-Hui; Kang, Zhen-Hui; Li, Yang-Guang
Polyoxometalate-based electron transfer modulation for efficient electrocatalytic carbon dioxide reduction
Chemical Science, 2020, 11, 3007-3015
1557285 CIFC49 H39 Mn3 Mo12 N11 O49 PP -113.034; 15.6737; 20.2719
79.875; 88.908; 87.011
4071.1Du, Jing; Lang, Zhong-Ling; Ma, Yuan-Yuan; Tan, Hua-Qiao; Liu, Bai-Ling; Wang, Yong-Hui; Kang, Zhen-Hui; Li, Yang-Guang
Polyoxometalate-based electron transfer modulation for efficient electrocatalytic carbon dioxide reduction
Chemical Science, 2020, 11, 3007-3015
1557286 CIFC49 H39 Mn3 N11 O49 P W12P -113.0328; 15.6142; 20.1424
79.88; 89.029; 86.775
4028.6Du, Jing; Lang, Zhong-Ling; Ma, Yuan-Yuan; Tan, Hua-Qiao; Liu, Bai-Ling; Wang, Yong-Hui; Kang, Zhen-Hui; Li, Yang-Guang
Polyoxometalate-based electron transfer modulation for efficient electrocatalytic carbon dioxide reduction
Chemical Science, 2020, 11, 3007-3015
1557287 CIFC25 H22 N2 O3P 1 21 19.0919; 9.9836; 11.7719
90; 95.822; 90
1063.02Zhang, Xiang; Li, Xiang; Li, Jun-Long; Wang, Qi-Wei; Zou, Wen-Lin; Liu, Yan-Qing; Jia, Zhi-Qiang; Peng, Fu; Han, Bo
Regiodivergent construction of medium-sized heterocycles from vinylethylene carbonates and allylidenemalononitriles
Chemical Science, 2020, 11, 2888-2894
1557288 CIFC25 H22 N2 O3P 1 21/n 19.6576; 13.2796; 17.3578
90; 99.745; 90
2194Zhang, Xiang; Li, Xiang; Li, Jun-Long; Wang, Qi-Wei; Zou, Wen-Lin; Liu, Yan-Qing; Jia, Zhi-Qiang; Peng, Fu; Han, Bo
Regiodivergent construction of medium-sized heterocycles from vinylethylene carbonates and allylidenemalononitriles
Chemical Science, 2020, 11, 2888-2894
1557289 CIFC25 H22 N2 O3P -17.8691; 9.8641; 13.184
87.285; 85.531; 74.852
984.41Zhang, Xiang; Li, Xiang; Li, Jun-Long; Wang, Qi-Wei; Zou, Wen-Lin; Liu, Yan-Qing; Jia, Zhi-Qiang; Peng, Fu; Han, Bo
Regiodivergent construction of medium-sized heterocycles from vinylethylene carbonates and allylidenemalononitriles
Chemical Science, 2020, 11, 2888-2894
1557290 CIFC2 H Cl N4P b c a11.2724; 6.279; 12.5272
90; 90; 90
886.67Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557291 CIFC8 H6 N4 OP 1 21/c 110.7358; 5.14454; 14.9437
90; 105.056; 90
797.02Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557292 CIFC10 H7 N5F d d 238.7645; 11.93147; 7.70847
90; 90; 90
3565.3Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557293 CIFC9 H9 N7 O2 S2C 1 2/c 117.7417; 6.22991; 23.2377
90; 93.9389; 90
2562.38Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557294 CIFC2 H Br N4P b c a12.7468; 5.60166; 12.9507
90; 90; 90
924.72Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557295 CIFC17 H21 N5 O5C 1 2 132.663; 5.161; 11.0162
90; 94.704; 90
1850.79Schnell, Simon D.; Hoff, Lukas V.; Panchagnula, Advaita; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Sieber, Simon; Linden, Anthony; Gademann, Karl
3-Bromotetrazine: labelling of macromolecules via monosubstituted bifunctional s-tetrazines
Chemical Science, 2020, 11, 3042-3047
1557296 CIFC22 H39 Al Ge Si2P 1 21/n 19.6414; 13.3432; 19.6279
90; 95.4683; 90
2513.6Albers, Lena; Tholen, Patrik; Schmidtmann, Marc; Müller, Thomas
A germaaluminocene
Chemical Science, 2020, 11, 2982-2986
1557297 CIFC23 H19 N3 O5P 1 21 111.2231; 8.1552; 11.9835
90; 115.45; 90
990.4Warghude, Prakash K.; Sabale, Abhijeet S.; Bhat, Ramakrishna G.
Access to highly enantioselective and diastereoselective spirooxindole dihydrofuran fused pyrazolones.
Organic & biomolecular chemistry, 2020, 18, 1794-1799
1557298 CIFC6 H12 O6P 21 21 217.7012; 7.7746; 12.6751
90; 90; 90
758.91Zhou, Qing; Yang, Tianjia; Zhong, Zihao; Kausar, Fahmeeda; Wang, Ziyi; Zhang, Yongming; Yuan, Wang Zhang
A clustering-triggered emission strategy for tunable multicolor persistent phosphorescence
Chemical Science, 2020, 11, 2926-2933
1557299 CIFC5 H12 O4I -46.0826; 6.0826; 8.792
90; 90; 90
325.29Zhou, Qing; Yang, Tianjia; Zhong, Zihao; Kausar, Fahmeeda; Wang, Ziyi; Zhang, Yongming; Yuan, Wang Zhang
A clustering-triggered emission strategy for tunable multicolor persistent phosphorescence
Chemical Science, 2020, 11, 2926-2933
1557300 CIFC5 H10 O5P 21 21 215.6107; 9.1858; 12.5998
90; 90; 90
649.38Zhou, Qing; Yang, Tianjia; Zhong, Zihao; Kausar, Fahmeeda; Wang, Ziyi; Zhang, Yongming; Yuan, Wang Zhang
A clustering-triggered emission strategy for tunable multicolor persistent phosphorescence
Chemical Science, 2020, 11, 2926-2933
1557301 CIFC6 H12 O6P 21 21 218.091; 9.212; 10.056
90; 90; 90
749.5Zhou, Qing; Yang, Tianjia; Zhong, Zihao; Kausar, Fahmeeda; Wang, Ziyi; Zhang, Yongming; Yuan, Wang Zhang
A clustering-triggered emission strategy for tunable multicolor persistent phosphorescence
Chemical Science, 2020, 11, 2926-2933
1557302 CIF
HKL
Paper
C20 H18 N4 O2P b c a8.7438; 18.7561; 20.8005
90; 90; 90
3411.27Powell, Gregory L.; Rix, Brad A.
5-Methyl-4-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one
IUCrData, 2020, 5, x200121
1557303 CIF
HKL
Paper
C5 H20 Cs2 Mg4 O25P 1 21/n 19.1617; 19.233; 13.0065
90; 91.136; 90
2291.4Rincke, Christine; Schmidt, Horst; Voigt, Wolfgang
Dicaesium tetramagnesium pentakis(carbonate) decahydrate, Cs2Mg4(CO3)5·10H2O
IUCrData, 2020, 5
1557304 CIF
HKL
Paper
C11 H10 N2 O2 S2P 1 21 14.1658; 10.4706; 12.7624
90; 95.958; 90
553.67Siegel, David J.; Howarth, Alexis N.; Traver, Joseph R.; Hillesheim, Patrick C.; Zeller, Matthias; Mirjafari, Arsalan
2,2'-[Methylenebis(sulfanediyl)]bis(pyridine 1-oxide)
IUCrData, 2020, 5, x200171
1557305 CIF
HKL
Paper
C21 H20 Br N O4 SP 4111.076; 11.076; 16.478
90; 90; 90
2021.5Soundararajan, Krishnan; Sethuraman, Velusamy; Thanigaimani, Kaliyaperumal
(3<i>S</i>,5<i>R</i>,6<i>S</i>)-Diphenylmethyl 1-oxo-6-bromopenicillanate
IUCrData, 2020, 5, x200143
1557306 CIF
HKL
Paper
C21 H39 N S2P 1 21 15.5457; 9.1108; 43.511
90; 90.376; 90
2198.4Muller II, Joseph E.; Osborn, Laura R.; Traver, Joseph R.; Hillesheim, Patrick C.; Zeller, Matthias; Mirjafari, Arsalan
2-(Octadecylsulfanyl)-1,3-thiazole
IUCrData, 2020, 5, x200170
1557311 CIFC12 H13 Cl5 O2P 1 21/c 118.071; 9.5329; 17.7642
90; 99.613; 90
3017.25Steinbiss, Michael; Maczka, Michael; Langewald, Juergen; London, Brecht; Vallinayagam, Ramakrishnan; Jones, Peter G.; Bastiaans, Harold; Schulz, Stefan
Sigillins from Springtails Are Potent Natural Insecticides.
Journal of natural products, 2020, 83, 468-472
1557312 CIFC12 H14 Cl6 O5P 418.98338; 8.98338; 20.8299
90; 90; 90
1681Steinbiss, Michael; Maczka, Michael; Langewald, Juergen; London, Brecht; Vallinayagam, Ramakrishnan; Jones, Peter G.; Bastiaans, Harold; Schulz, Stefan
Sigillins from Springtails Are Potent Natural Insecticides.
Journal of natural products, 2020, 83, 468-472
1557313 CIFC30 H44 O5P 21 21 2110.5518; 16.1297; 17.0893
90; 90; 90
2908.55Ye, Yan-Song; Li, Wen-Yan; Du, Shu-Zong; Yang, Jian; Nian, Yin; Xu, Gang
Congenetic hybrids derived from dearomatized isoprenylated acylphloroglucinol with opposite effects on Ca<sub>v</sub>3.1 low voltage-gated Ca<sup>2+</sup> channel.
Journal of medicinal chemistry, 2020
1557314 CIFC33 H40 O4P 21 21 219.4737; 15.6173; 18.4421
90; 90; 90
2728.58Ye, Yan-Song; Li, Wen-Yan; Du, Shu-Zong; Yang, Jian; Nian, Yin; Xu, Gang
Congenetic hybrids derived from dearomatized isoprenylated acylphloroglucinol with opposite effects on Ca<sub>v</sub>3.1 low voltage-gated Ca<sup>2+</sup> channel.
Journal of medicinal chemistry, 2020
1557315 CIFC6 H12 F N0.5 Na0.5 O5 S2.5I 1 2/a 111.9451; 11.9286; 16.2807
90; 101.179; 90
2275.79Okamoto, Yukihiro; Tsuzuki, Seiji; Tatara, Ryoichi; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi
High Transference Number of Na Ion in Liquid-State Sulfolane Solvates of Sodium Bis(fluorosulfonyl)amide
The Journal of Physical Chemistry C, 2020
1557320 CIF
Paper
C16 H9 N3 O2 S2P 1 21 19.6598; 7.4249; 11.2457
90; 109.745; 90
759.15de Freitas, Jorge F.; Brown, Shayne; Oberndorfer, James S.; Crundwell, Guy
5-Nitro-2,3-bis(thiophen-2-yl)quinoxaline
IUCrData, 2020, 5, x200196
1557321 CIF
HKL
Paper
C16 H9 N3 O2 S2P 1 21/c 111.7649; 5.3386; 24.3536
90; 105.61; 90
1473.18de Freitas, Jorge F.; Brown, Shayne; Oberndorfer, James S.; Crundwell, Guy
6-Nitro-2,3-bis(thiophen-2-yl)quinoxaline
IUCrData, 2020, 5, x200203
1557327 CIFC16 H16 Cu N2 O6P 1 21/n 18.4484; 4.8581; 18.7404
90; 94.79; 90
766.48Smellie, Iain A.; Abdelhamid, Yusra; Carpenter-Warren, Cameron L.; Cordes, David B.; Elliott, Clement; Lamorte, Sarah; Patterson, Iain L. J.; Sanders, William; Sandison, Iain P.; Slawin, Alexandra M. Z.; Stewart, Dominic M.; Walters, Samuel N.
A Simplified Extractive Metallurgy Exercise to Demonstrate Selective Extraction of Copper
Journal of Chemical Education, 2020
1557328 CIFC15 H16 N2 O4P 1 21 16.9821; 8.6527; 11.9259
90; 105.761; 90
693.4Benedetti, Françoise; Perrin, Marc-Antoine; Bosc, Sebastien; Chouteau, Franck; Champion, Nicolas; Bigot, Antony
Total Synthesis of (+)-Oxo-tomaymycin
Organic Process Research & Development, 2020
1557329 CIFC37 H40 Al Cl2 N4 O5P -110.6552; 12.4511; 14.8269
100.087; 96.082; 90.524
1925Luke, Anna M.; Peterson, Appie; Chiniforoush, Sina; Mandal, Mukunda; Popowski, Yanay; Sajjad, Hussnain; Bouchey, Caitlin J.; Shopov, Dimitar Y.; Graziano, Brendan J.; Yao, Letitia J.; Cramer, Christopher J.; Reineke, Theresa M.; Tolman, William B.
Mechanism of Initiation Stereocontrol in Polymerization of rac-Lactide by Aluminum Complexes Supported by Indolide‒Imine Ligands
Macromolecules, 2020
1557330 CIFC33.5 H33 Al N4 OP 1 21/c 112.393; 20.309; 11.565
90; 104.827; 90
2813.9Luke, Anna M.; Peterson, Appie; Chiniforoush, Sina; Mandal, Mukunda; Popowski, Yanay; Sajjad, Hussnain; Bouchey, Caitlin J.; Shopov, Dimitar Y.; Graziano, Brendan J.; Yao, Letitia J.; Cramer, Christopher J.; Reineke, Theresa M.; Tolman, William B.
Mechanism of Initiation Stereocontrol in Polymerization of rac-Lactide by Aluminum Complexes Supported by Indolide‒Imine Ligands
Macromolecules, 2020
1557331 CIFC203.82 H244.63 Cl7.63 N0 O40P -111.5721; 16.6408; 26.1539
84.725; 81.758; 89.936
4962.9Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557332 CIFC112.95 H130.95 Cl15.56 O28P 114.334; 15.534; 16.891
69.752; 70.947; 76.995
3308.6Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557333 CIFC106 H124 Cl6 O20P 1 21/n 119.6983; 20.2034; 26.3162
90; 97.77; 90
10377Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557334 CIFC108.36 H122.64 Cl2.26 O20P 1 21/c 121.532; 19.643; 25.299
90; 90.699; 90
10699Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557335 CIFC116.82 H140.82 Cl8.45 O28P -114.4911; 17.0462; 27.359
72.867; 86.978; 77.872
6313.8Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557336 CIFC76 H74 O11P -113.0381; 16.6752; 17.4483
61.711; 79.037; 74.295
3207.14Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557337 CIFC226.36 H257.54 O43.98P 1 21/c 121.154; 19.669; 25.429
90; 90.27; 90
10580Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P.
Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes.
Chemical science, 2020, 11, 2614-2620
1557338 CIFC31 H53 B Eu N5 O17P 1 21/n 113.2696; 15.8873; 18.2435
90; 93.3; 90
3839.7Breen, Colum; Pal, Robert; Elsegood, Mark R. J.; Teat, Simon J.; Iza, Felipe; Wende, Kristian; Buckley, Benjamin R.; Butler, Stephen J.
Time-resolved luminescence detection of peroxynitrite using a reactivity-based lanthanide probe
Chemical Science, 2020, 11, 3164-3170
1557341 CIFC15 H21 Cl0 N O2P 21 21 218.5161; 10.575; 15.9557
90; 90; 90
1436.93Lin, Qianchi; Hu, Bowen; Xu, Xi; Dong, Shunxi; Liu, Xiaohua; Feng, Xiaoming
Chiral N,N′-dioxide/Mg(OTf)2 complex-catalyzed asymmetric [2,3]-rearrangement of in situ generated ammonium salts
Chemical Science, 2020, 11, 3068-3073
1557342 CIFC22 H14 OP 1 21 16.5602; 14.7939; 14.8216
90; 91.727; 90
1437.8Huang, Yue-E; Wang, Xing-Zhi; Hu, Peng; Qi, Xing-Hui; Huang, Xiao-Ying; Kloc, Christian; Wu, Xiaohui; Du, Ke-Zhao
Single-photon upconversion in 6-pentaceneone crystal from bulk to ultrathin flakes.
Nanoscale, 2020, 12, 6227-6232
1557352 CIFC30 H44 O8C 1 2 137.059; 6.5105; 12.0031
90; 104.561; 90
2803Huang, Yanjie; Li, Xian; Peng, Xing-Rong; Adegoke, Adelakum Tiwalade; Chen, Jian-Chao; Su, Hai-Guo; Hu, Gui-Lin; Wei, Gang; Qiu, Ming-Hua
NMR-based Structural Classification, Identification, and Quantification of Triterpenoids from Edible Mushroom Ganoderma resinaceum.
Journal of agricultural and food chemistry, 2020
1557353 CIFC30 H44 O7P 21 21 218.7074; 11.7878; 26.4646
90; 90; 90
2716.36Huang, Yanjie; Li, Xian; Peng, Xing-Rong; Adegoke, Adelakum Tiwalade; Chen, Jian-Chao; Su, Hai-Guo; Hu, Gui-Lin; Wei, Gang; Qiu, Ming-Hua
NMR-based Structural Classification, Identification, and Quantification of Triterpenoids from Edible Mushroom Ganoderma resinaceum.
Journal of agricultural and food chemistry, 2020
1557354 CIFC35 H37 Cl2 N O P2 Ru SP 1 21/c 112.599; 9.671; 27.353
90; 98.957; 90
3292.2Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557355 CIFC41 H41 Cl2 N O P2 Ru SP 1 21/n 117.8808; 10.6576; 19.6658
90; 96.36; 90
3724.6Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557356 CIFC38 H43 Cl2 N O P2 Ru SP 1 21/c 111.84; 31.81; 10.563
90; 111.468; 90
3702Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557357 CIFC40 H39 Cl2 N O P2 Ru SP b c a10.2315; 22.51; 31.197
90; 90; 90
7185Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557358 CIFC36 H39 Cl4 N P2 Ru SP -110.4094; 13.855; 13.8759
72.843; 74.273; 73.643
1795.8Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557359 CIFC38 H43 Cl2 N P2 Ru SP 1 21/c 110.1683; 17.5052; 20.3353
90; 100.513; 90
3558.9Dub, Pavel A.; Batrice, Rami J.; Gordon, John C.; Scott, Brian L.; Minko, Yury; Schmidt, Jurgen G.; Williams, Robert F.
Engineering Catalysts for Selective Ester Hydrogenation
Organic Process Research & Development, 2020
1557360 CIFC8 H14 N2 O4P 1 21/c 15.6483; 9.0345; 9.1851
90; 103.599; 90
455.57Blake, Timothy R.; Ho, Wilson C.; Turlington, Christopher R.; Zang, Xiaoyu; Huttner, Melanie A.; Wender, Paul A.; Waymouth, Robert M.
Synthesis and mechanistic investigations of pH-responsive cationic poly(aminoester)s
Chemical Science, 2020, 11, 2951-2966
1557361 CIFC30 H28 Cl2 F17 N3 O3 PtP -17.4767; 11.673; 21.5145
96.026; 90.715; 98.636
1845.38Kolari, Kalle; Bulatov, Evgeny; Tatikonda, Rajendhraprasad; Bertula, Kia; Kalenius, Elina; Nonappa, ?; Haukka, Matti
Self-healing, luminescent metallogelation driven by synergistic metallophilic and fluorine-fluorine interactions.
Soft matter, 2020, 16, 2795-2802
1557362 CIFC33 H53 Cl2 N3 O4 PtP -17.4212; 12.1297; 20.0591
82.046; 86.277; 85.498
1780.09Kolari, Kalle; Bulatov, Evgeny; Tatikonda, Rajendhraprasad; Bertula, Kia; Kalenius, Elina; Nonappa, ?; Haukka, Matti
Self-healing, luminescent metallogelation driven by synergistic metallophilic and fluorine-fluorine interactions.
Soft matter, 2020, 16, 2795-2802
1557368 CIF
HKL
Paper
C24 H20 O2P 1 21/n 121.55; 6.0366; 27.4915
90; 92.111; 90
3573.9Manickam, R.; Jagadeesan, G.; Karunakaran, J.; Srinivasan, G.
1,4-Bis(4-methoxyphenyl)naphthalene
IUCrData, 2020, 5, x200212
1557369 CIF
HKL
Paper
C13 H16 N2 O3 SP 1 21/n 114.6392; 5.7111; 17.5295
90; 102.349; 90
1431.66Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
2-Aminoanilinium 4-methylbenzenesulfonate
IUCrData, 2020, 5, x200230
1557370 CIF
HKL
Paper
C26 H34 O4 Si2P 1 21/c 110.2628; 20.5653; 13.3923
90; 111.638; 90
2627.4Weil, Matthias; Kremsmayr, Thomas; Mihovilovic, Marko D.
6-[(<i>tert</i>-Butyldimethylsilyl)oxy]-3-ethenyl-7-methoxy-4-[(trimethylsilyl)ethynyl]naphtho[2,3-<i>c</i>]furan-1(3<i>H</i>)-one
IUCrData, 2020, 5, x200224
1557371 CIFC27 H19 N O3P 17.1378; 9.8466; 14.7942
88.9786; 79.0044; 74.6213
983.56Sasaki, Yui; Kojima, Soya; Hamedpour, Vahid; Kubota, Riku; Takizawa, Shin-ya; Yoshikawa, Isao; Houjou, Hirohiko; Kubo, Yuji; Minami, Tsuyoshi
Accurate chiral pattern recognition for amines from just a single chemosensor
Chemical Science, 2020, 11, 3790-3796
1557372 CIFC20 H12 SP b c n21.4461; 8.4399; 7.3436
90; 90; 90
1329.21Xu, Niansheng; Zheng, Aibin; Wei, Yuefang; Yuan, Yi; Zhang, Jing; Lei, Ming; Wang, Peng
D‒π‒D molecular semiconductors for perovskite solar cells: the superior role of helical versus planar π-linkers
Chemical Science, 2020, 11, 3418-3426
1557373 CIFC48 H36 N2 O4 SP -19.2973; 11.5371; 17.8524
99.629; 101.049; 97.562
1826.25Xu, Niansheng; Zheng, Aibin; Wei, Yuefang; Yuan, Yi; Zhang, Jing; Lei, Ming; Wang, Peng
D‒π‒D molecular semiconductors for perovskite solar cells: the superior role of helical versus planar π-linkers
Chemical Science, 2020, 11, 3418-3426
1557374 CIFC97 H78 Cl2 N4 O8 S2P -110.5796; 13.7266; 14.368
85.956; 83.941; 82.064
2051.7Xu, Niansheng; Zheng, Aibin; Wei, Yuefang; Yuan, Yi; Zhang, Jing; Lei, Ming; Wang, Peng
D‒π‒D molecular semiconductors for perovskite solar cells: the superior role of helical versus planar π-linkers
Chemical Science, 2020, 11, 3418-3426
1557375 CIFC17 H26 O5P 1 21 19.8562; 7.7464; 10.34
90; 91.055; 90
789.33Fu, Yifan; Ding, Xiaoyu; Zhang, Xianglei; Shao, Xingcheng; Zhao, Jihui; Xu, Yechun; Luo, Xiaomin; Zhao, Weimin
Diterpenoids from the Root Bark of Pinus massoniana and Evaluation of Their Phosphodiesterase Type 4D Inhibitory Activity
Journal of Natural Products, 2020
1557376 CIFC22 H14 Au2 Fe N6P 1 21/c 110.8116; 14.4381; 14.9803
90; 96.596; 90
2322.93Chen, Yan-Cong; Meng, Yan; Dong, Yan-Jie; Song, Xiao-Wei; Huang, Guo-Zhang; Zhang, Chuan-Lei; Ni, Zhao-Ping; Navařík, Jakub; Malina, Ondřej; Zbořil, Radek; Tong, Ming-Liang
Light- and temperature-assisted spin state annealing: accessing the hidden multistability
Chemical Science, 2020, 11, 3281-3289
1557377 CIFC22 H14 Au2 Fe N6P 1 21/c 110.7397; 14.1109; 14.679
90; 95.98; 90
2212.5Chen, Yan-Cong; Meng, Yan; Dong, Yan-Jie; Song, Xiao-Wei; Huang, Guo-Zhang; Zhang, Chuan-Lei; Ni, Zhao-Ping; Navařík, Jakub; Malina, Ondřej; Zbořil, Radek; Tong, Ming-Liang
Light- and temperature-assisted spin state annealing: accessing the hidden multistability
Chemical Science, 2020, 11, 3281-3289
1557378 CIFC22 H14 Au2 Fe N6P 1 21/c 110.7739; 13.9861; 14.5762
90; 95.77; 90
2185.28Chen, Yan-Cong; Meng, Yan; Dong, Yan-Jie; Song, Xiao-Wei; Huang, Guo-Zhang; Zhang, Chuan-Lei; Ni, Zhao-Ping; Navařík, Jakub; Malina, Ondřej; Zbořil, Radek; Tong, Ming-Liang
Light- and temperature-assisted spin state annealing: accessing the hidden multistability
Chemical Science, 2020, 11, 3281-3289
1557379 CIFC22 H14 Au2 Fe N6P -110.7701; 14.1621; 14.7425
90.082; 96.077; 90.471
2235.9Chen, Yan-Cong; Meng, Yan; Dong, Yan-Jie; Song, Xiao-Wei; Huang, Guo-Zhang; Zhang, Chuan-Lei; Ni, Zhao-Ping; Navařík, Jakub; Malina, Ondřej; Zbořil, Radek; Tong, Ming-Liang
Light- and temperature-assisted spin state annealing: accessing the hidden multistability
Chemical Science, 2020, 11, 3281-3289
1557380 CIFC60 H56 B2 F8 N2 O8P 1 n 112.5252; 16.8071; 12.9207
90; 90.786; 90
2719.7Kim, Inwon; Im, Honggu; Lee, Hyeonyeong; Hong, Sungwoo
N-Heterocyclic carbene-catalyzed deaminative cross-coupling of aldehydes with Katritzky pyridinium salts
Chemical Science, 2020, 11, 3192-3197
1557381 CIFC23 H23 N O2P 1 21/c 19.3351; 20.6304; 9.7275
90; 105.289; 90
1807.1Kim, Inwon; Im, Honggu; Lee, Hyeonyeong; Hong, Sungwoo
N-Heterocyclic carbene-catalyzed deaminative cross-coupling of aldehydes with Katritzky pyridinium salts
Chemical Science, 2020, 11, 3192-3197
1557382 CIFC33 H28 B F4 N O2P 1 21/n 111.0604; 16.678; 15.1704
90; 100.639; 90
2750.3Kim, Inwon; Im, Honggu; Lee, Hyeonyeong; Hong, Sungwoo
N-Heterocyclic carbene-catalyzed deaminative cross-coupling of aldehydes with Katritzky pyridinium salts
Chemical Science, 2020, 11, 3192-3197
1557383 CIFC20 H21 N O4P 1 21/c 19.2314; 19.6394; 19.9121
90; 93.605; 90
3602.9Kim, Inwon; Im, Honggu; Lee, Hyeonyeong; Hong, Sungwoo
N-Heterocyclic carbene-catalyzed deaminative cross-coupling of aldehydes with Katritzky pyridinium salts
Chemical Science, 2020, 11, 3192-3197
1557384 CIFC17 H18 F2 O2 SP 1 21/c 18.497; 13.357; 13.775
90; 85.689; 90
1559Huang, Xin; Zhang, Yage; Liang, Weijian; Zhang, Qifeng; Zhan, Yaling; Kong, Lichun; Peng, Bo
Dearomatization of aryl sulfoxides: a switch between mono- and dual-difluoroalkylation
Chemical Science, 2020, 11, 3048-3053
1557385 CIFC33 H29 Cl F4 O4 S2P -110.2309; 13.2445; 13.5012
66.799; 70.33; 75.627
1569.19Huang, Xin; Zhang, Yage; Liang, Weijian; Zhang, Qifeng; Zhan, Yaling; Kong, Lichun; Peng, Bo
Dearomatization of aryl sulfoxides: a switch between mono- and dual-difluoroalkylation
Chemical Science, 2020, 11, 3048-3053
1557386 CIFC23 H12 Br F6 NC 1 2/c 115.327; 9.854; 28.274
90; 104.113; 90
4141.4Jyothi, Mane; Annadhasan, Mari; Vinay Pradeep, Vuppu; Chandrasekar, Rajadurai
Direct micro-scale monitoring of molecular aggregation, its growth and diffusion via aggregation-induced emission.
Soft matter, 2020, 16, 2664-2668
1557387 CIFC28 H20 N2 O6 ZnP 1 2/n 114.2399; 7.5126; 14.7479
90; 101.619; 90
1545.38Park, In-Hyeok; Dey, Atanu; Sasaki, Kenta; Ohba, Masaaki; Lee, Shim Sung; Vittal, Jagadese J.
Disappeared supramolecular isomer reappears with perylene guest
IUCrJ, 2020, 7, 324-330
1557388 CIFC56 H40 N4 O12 Zn2P 1 2/c 120.1826; 18.7307; 17.1854
90; 91.583; 90
6494.2Park, In-Hyeok; Dey, Atanu; Sasaki, Kenta; Ohba, Masaaki; Lee, Shim Sung; Vittal, Jagadese J.
Disappeared supramolecular isomer reappears with perylene guest
IUCrJ, 2020, 7, 324-330
1557389 CIFC38 H26 N2 O6 ZnC 1 2/c 128.18; 14.88; 18.158
90; 124.421; 90
6280.8Park, In-Hyeok; Dey, Atanu; Sasaki, Kenta; Ohba, Masaaki; Lee, Shim Sung; Vittal, Jagadese J.
Disappeared supramolecular isomer reappears with perylene guest
IUCrJ, 2020, 7, 324-330
1557394 CIFC16 H14 O2P 1 21 16.2309; 7.4169; 13.0054
90; 90.1686; 90
601.03Liu, Lei; Lee, Wes; Yuan, Mingbin; Acha, Chris; Geherty, Michael B.; Williams, Brandon; Gutierrez, Osvaldo
Intra- and intermolecular Fe-catalyzed dicarbofunctionalization of vinyl cyclopropanes
Chemical Science, 2020, 11, 3146-3151
1557395 CIFC102 H68 N18 O27 Zn8R -3 :H22.979; 22.979; 15.496
90; 90; 120
7086Chen, Sheng-Chun; Zhang, Fei-Hang; Huang, Kun-Lin; Tian, Feng; Zhang, Zhi-Hui; Zhou, Renxian; Feng, Xue-Jun; Zhou, Xiaoying; He, Ming-Yang; Gu, Jiande; Chen, Qun; Wu, Chuan-De
The crucial roles of guest water in a biocompatible coordination network in the catalytic ring-opening polymerization of cyclic esters: a new mechanistic perspective
Chemical Science, 2020, 11, 3345-3354
1557396 CIFC30 H26 B BrP 1 21/c 116.2062; 8.1904; 17.137
90; 91.218; 90
2274.2Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557397 CIFC36 H36 B BrP -18.4803; 9.1672; 19.9099
80.254; 85.195; 68.593
1419.82Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557398 CIFC22 H26 B Br O2P 1 21/n 16.4265; 15.8695; 20.617
90; 97.511; 90
2084.6Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557399 CIFC62 H78 B2 Br2P -19.4752; 9.8107; 15.1088
93.579; 100.145; 90.47
1379.57Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557400 CIFC22 H26 B Br O2P c a 2120.7096; 6.4384; 15.5735
90; 90; 90
2076.52Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557401 CIFC14 H10 B Br3P 1 21/n 113.2781; 5.936; 18.4485
90; 100.58; 90
1429.37Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267
1557402 CIFC44 H42 B2 Br2 O2P c c n42.071; 29.3977; 6.6541
90; 90; 90
8229.7Yuan, K.; Kahan, R. J.; Si, C.; Williams, A.; Kirschner, S.; Uzelac, M.; Zysman-Colman, E.; Ingleson, M. J.
The synthesis of brominated-boron-doped PAHs by alkyne 1,1-bromoboration: mechanistic and functionalisation studies
Chemical Science, 2020, 11, 3258-3267

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