Crystallography Open Database

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Searching year of publication is 2021

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1567272 CIFD2 OA 1 2/a 19.19256; 7.52147; 10.31017
90; 109.317; 90
672.728Salzmann, C. G.; Rosu-Finsen, A.; Sharif, Z.; Radaelli, P.G.; Finney, J. L.
Detailed crystallographic analysis of the ice V to ice XIII hydrogen-ordering phase transition
The Journal of Chemical Physics, 2021, 154, 134504
1564544 CIFC4 H4 B K O12A e a 211.0579; 11.1695; 9.0504
90; 90; 90
1117.83TOMBUL, Mustafa; TÜRKMENOGLU, Elmas; SAHIN, Onur
Unprecedented Formation of Potassium Borate Based Carbonate from Chloral Hydrate, Potassium Carbonate and Boric Acid
X-ray Structure Analysis Online, 2021, 37, 45-47
1565426 CIFC16 H22 B9 N OA e a 212.6535; 21.2265; 15.7104
90; 90; 90
4219.6Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong
Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums
Chemical Science, 2021
2243731 CIF
HKL
Paper
C26 H22 Cd N8 O4A e a 212.6654; 17.6394; 10.888
90; 90; 90
2432.49Yang, Ping; Xie, Xiao-Bao; Shi, Qing-Shan
Crystal structure of bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II)
Acta Crystallographica Section E, 2021, 77, 153-157
4004025 CIFHg3 P2 S8A e a 216.52; 8.223; 9.293
90; 90; 90
1262Chu, Yu; Wang, Peng; Zeng, Hao; Cheng, Shichao; Su, Xin; Yang, Zhihua; Li, Junjie; Pan, Shilie
Hg3P2S8: A New Promising Infrared Nonlinear Optical Material with a Large Second-Harmonic Generation and a High Laser-Induced Damage Threshold
Chemistry of Materials, 2021, 33, 6514-6521
4518923 CIFHg3 P2 S8A e a 216.3786; 8.1613; 9.2723
90; 90; 90
1239.43Xing, Wenhao; Liang, Fei; Tang, Chunlan; Uykur, Ece; Lin, Zheshuai; Yao, Jiyong; Yin, Wenlong; Kang, Bin
Highly Distorted [HgS<sub>4</sub>] Motif-Driven Structural Symmetry Degradation and Strengthened Second-Harmonic Generation Response in the Defect Diamond-Like Chalcogenide Hg<sub>3</sub>P<sub>2</sub>S<sub>8</sub>.
ACS applied materials & interfaces, 2021
7127827 CIFC19 H15 NA e a 216.7467; 21.6002; 7.8088
90; 90; 90
2824.69Qi, Zhi-Chao; Lou, Qin-Xin; Niu, Yuan; Yang, Shang-Dong
Temporary (P[double bond, length as m-dash]O) directing group enabled carbazole ortho arylation via palladium catalysis.
Chemical communications (Cambridge, England), 2021, 57, 2021-2024
7158112 CIFC10 H16 F5 N O4 SA e a 213.4208; 26.557; 8.6349
90; 90; 90
3077.6Dudziński, Piotr; Husstedt, Wibke S.; Matsnev, Andrej V.; Thrasher, Joseph S.; Haufe, Günter
Synthesis and [3,3]-sigmatropic rearrangements of 5-(pentafluorosulfanyl)-pent-3-en-2-ol, its homologues, and trifluoromethyl analogues.
Organic & biomolecular chemistry, 2021, 19, 5607-5623
7243091 CIFB5 H12 N O12A e a 211.3246; 11.0147; 9.1513
90; 90; 90
1141.51Kusy, Rafał; Grela, Karol
Ligand-free (Z)-selective transfer semihydrogenation of alkynes catalyzed by in situ generated oxidizable copper nanoparticles
Green Chemistry, 2021, 23, 5494-5502
7243326 CIFC18 H12 F4 I2 N2A e a 213.1529; 18.502; 15.239
90; 90; 90
3708.5Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T.
One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes
CrystEngComm, 2021, 23, 6098-6106
7243506 CIFC44 H56 N9 O9 Zn2A e a 226.205; 25.903; 14.652
90; 90; 90
9946Basak, Tanmoy; Frontera, Antonio; Chattopadhyay, Shouvik
Synthesis and characterization of a mononuclear zinc(ii) Schiff base complex: on the importance of C‒H⋯π interactions
RSC Advances, 2021, 11, 30148-30155
7707082 CIFLa P3 SiA e a 25.965; 25.2125; 5.8168
90; 90; 90
874.8Akopov, Georgiy; Mark, Justin; Viswanathan, Gayatri; Lee, Shannon J.; McBride, Brennan C.; Won, Juyeon; Perras, Frédéric A; Paterson, Alexander L.; Yuan, Bing; Sen, Sabyasachi; Adeyemi, Adedoyin N.; Zhang, Feng; Wang, Cai-Zhuang; Ho, Kai-Ming; Miller, Gordon J.; Kovnir, Kirill
Third time's the charm: intricate non-centrosymmetric polymorphism in <i>Ln</i>SiP<sub>3</sub> (<i>Ln</i> = La and Ce) induced by distortions of phosphorus square layers.
Dalton transactions (Cambridge, England : 2003), 2021, 50, 6463-6476
7707085 CIFCe P3 SiA e a 25.8961; 25.0987; 5.7747
90; 90; 90
854.57Akopov, Georgiy; Mark, Justin; Viswanathan, Gayatri; Lee, Shannon J.; McBride, Brennan C.; Won, Juyeon; Perras, Frédéric A; Paterson, Alexander L.; Yuan, Bing; Sen, Sabyasachi; Adeyemi, Adedoyin N.; Zhang, Feng; Wang, Cai-Zhuang; Ho, Kai-Ming; Miller, Gordon J.; Kovnir, Kirill
Third time's the charm: intricate non-centrosymmetric polymorphism in <i>Ln</i>SiP<sub>3</sub> (<i>Ln</i> = La and Ce) induced by distortions of phosphorus square layers.
Dalton transactions (Cambridge, England : 2003), 2021, 50, 6463-6476
7707327 CIFC56 H51 Au3 N3 P3A e a 236.692; 21.4267; 13.825
90; 90; 90
10869.1Ferrer, Montserrat; Gutiérrez, Albert; Martínez, Manuel; Da Silva, Cristiana; Netto, Adelino V. G.; Rodríguez, Laura; Romo-Islas, Guillermo; Pan, Fangfang; Rissanen, Kari
Base-assisted synthesis of 4-pyridinate gold(I) metallaligands: a study of their use in self-assembly reactions.
Dalton transactions (Cambridge, England : 2003), 2021, 50, 8154-8166
7707539 CIFC40 H36 N2 O4 P2 ZnA e a 226.0998; 17.2345; 7.9957
90; 90; 90
3596.6Yadav, Ravi; Dahlen, Milena; Singh, Akhil K.; Sun, Xiaofei; Gamer, Michael T.; Roesky, Peter W.
Nonanuclear zinc-gold [Zn<sub>3</sub>Au<sub>6</sub>] heterobimetallic complexes.
Dalton transactions (Cambridge, England : 2003), 2021, 50, 8558-8566
7708252 CIFC8 H20 N2 O2 SnA e a 211.8081; 10.1306; 10.0735
90; 90; 90
1205.02Johnson, Andrew Lee; Paish, James David; Snook, Michael
Evaluation of Sn(II) Aminoalkoxide Precursors for Atomic Layer Deposition of SnO Thin Films. Invitation: Dalton Transactions web collection themed around the topic of tin chemistry
Dalton Transactions, 2021
8104589 CIFC20 H28 N6 O3A e a 219.9676; 8.4674; 12.4082
90; 90; 90
2097.9Setshedi, Itumeleng B.; Lemmerer, Andreas; Smith, Mark G.
The crystal structure of (E)-N′-(butan-2-ylidene)isonicotinohydrazide 0.5 hydrate C10H13N3O·0.5H2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 1295-1296
2243832 CIF
HKL
Paper
C6 H5 N O4A e m 210.2045; 6.1282; 9.7293
90; 90; 90
608.42Behrman, Edward J.; Parkin, Sean
Synthesis and crystal structures of 3,6-dihydroxypicolinic acid and its labile intermediate dipotassium 3-hydroxy-6-(sulfonatooxy)pyridine-2-carboxylate monohydrate
Acta Crystallographica Section E, 2021, 77, 623-628
7706027 CIFC27 H21 Cl F6 N5 Ni O2 PA e m 28.6326; 22.3707; 16.5568
90; 90; 90
3197.4Boniolo, Manuel; Chernev, Petko; Cheah, Mun Hon; Heizmann, Philipp A.; Huang, Ping; Shylin, Sergii I.; Salhi, Nessima; Hossain, Md Kamal; Gupta, Arvind K.; Messinger, Johannes; Thapper, Anders; Lundberg, Marcus
Electronic and geometric structure effects on one-electron oxidation of first-row transition metals in the same ligand framework.
Dalton transactions (Cambridge, England : 2003), 2021, 50, 660-674
2108891 CIFC6 H12 N3 O3A m a 212.1054; 13.5537; 5.20741
90; 90; 90
854.4Gallo, Gianpiero; Terban, Maxwell W.; Moudrakovski, Igor; Huber, Tatjana; Etter, Martin; Ernst, Martin; Hinrichsen, Bernd; Dinnebier, Robert E.
A previously unknown cyclic alkanolamine and molecular ranking using the pair distribution function
Acta Crystallographica Section B, 2021, 77, 986-995

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