Crystallography Open Database

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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'

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2108602 CIF
HKL
Paper
C21 H20 Cl N2 O3 ReP 1 21/c 17.2923; 23.44; 12.75
90; 106.337; 90
2091.4Kia, Reza; Kalaghchi, Azadeh
Intra- and intermolecular interactions in a series of chlorido-tricarbonyl-diazabutadienerhenium(I) complexes: structural and theoretical studies
Acta Crystallographica Section B, 2020, 76
2108603 CIF
HKL
C23 H24.4 Cl N2 O3 ReP 1 21/c 18.2294; 36.355; 8.1035
90; 105.614; 90
2334.9Kia, Reza; Kalaghchi, Azadeh
Intra- and intermolecular interactions in a series of chlorido-tricarbonyl-diazabutadienerhenium(I) complexes: structural and theoretical studies
Acta Crystallographica Section B, 2020, 76
2108604 CIF
HKL
C25 H28 Cl N2 O3 ReP 1 21/c 19.998; 30.878; 8.209
90; 98.497; 90
2506.5Kia, Reza; Kalaghchi, Azadeh
Intra- and intermolecular interactions in a series of chlorido-tricarbonyl-diazabutadienerhenium(I) complexes: structural and theoretical studies
Acta Crystallographica Section B, 2020, 76
2108605 CIF
HKL
C29 H36 Cl N2 O3 ReP n m a13.0248; 21.7653; 10.421
90; 90; 90
2954.2Kia, Reza; Kalaghchi, Azadeh
Intra- and intermolecular interactions in a series of chlorido-tricarbonyl-diazabutadienerhenium(I) complexes: structural and theoretical studies
Acta Crystallographica Section B, 2020, 76
2108606 CIF
HKL
C52 H32 N8 O8 S2 Zn2P 1 21/c 17.8461; 20.359; 29.189
90; 94.612; 90
4647.5Shi, Zhi-Qiang; Ji, Ning-Ning; Hu, Hai-Liang
A new Zn^II^ metallocryptand with unprecedented diflexure helix induced by V-shaped diimidazole building blocks
Acta Crystallographica Section B, 2020, 76
2108607 CIF
HKL
C36 H58 O4P 1 21/c 122.486; 8.8585; 8.3874
90; 96.221; 90
1660.9Vadra, Nahir; Suarez, Sebastian A.; Slep, Leonardo D.; Manzano, Veronica E.; Halac, Emilia B.; Baggio, Ricardo F.; Cukiernik, Fabio D.
Synthesis and crystallographic, spectroscopic and computational characterization of 3,3',4,4'-substituted biphenyls: effects of O<i>R</i> substituents on the intra-ring torsion angle
Acta Crystallographica Section B, 2020, 76
2108608 CIF
HKL
C28 H38 O6P -18.554; 8.6844; 9.81
100.26; 109.1; 100.53
654.5Vadra, Nahir; Suarez, Sebastian A.; Slep, Leonardo D.; Manzano, Veronica E.; Halac, Emilia B.; Baggio, Ricardo F.; Cukiernik, Fabio D.
Synthesis and crystallographic, spectroscopic and computational characterization of 3,3',4,4'-substituted biphenyls: effects of O<i>R</i> substituents on the intra-ring torsion angle
Acta Crystallographica Section B, 2020, 76
2108609 CIF
HKL
C18 H18 O6P 1 21 111.304; 10.064; 14.496
90; 107.822; 90
1570Vadra, Nahir; Suarez, Sebastian A.; Slep, Leonardo D.; Manzano, Veronica E.; Halac, Emilia B.; Baggio, Ricardo F.; Cukiernik, Fabio D.
Synthesis and crystallographic, spectroscopic and computational characterization of 3,3',4,4'-substituted biphenyls: effects of O<i>R</i> substituents on the intra-ring torsion angle
Acta Crystallographica Section B, 2020, 76
2108610 CIF
HKL
C16 H18 O4P 1 21/c 113.1; 7.6709; 15.2881
90; 110.181; 90
1441.97Vadra, Nahir; Suarez, Sebastian A.; Slep, Leonardo D.; Manzano, Veronica E.; Halac, Emilia B.; Baggio, Ricardo F.; Cukiernik, Fabio D.
Synthesis and crystallographic, spectroscopic and computational characterization of 3,3',4,4'-substituted biphenyls: effects of O<i>R</i> substituents on the intra-ring torsion angle
Acta Crystallographica Section B, 2020, 76
2108611 CIFC9 H13 N O2 S2P 1 21/n 19.8106; 10.5345; 10.4312
90; 91.787; 90
1077.54Vénosová, Barbora; Koziskova, Julia; Kožíšek, Jozef; Herich, Peter; Lušpai, Karol; Petricek, Vaclav; Hartung, Jens; Müller, Mike; Hübschle, Christian B.; van Smaalen, Sander; Bucinsky, Lukas
Charge density of 4-methyl-3-[(tetrahydro-2<i>H</i>-pyran-2-yl)oxy]thiazole-2(3<i>H</i>)-thione. A comprehensive multipole refinement, maximum entropy method and density functional theory study
Acta Crystallographica Section B, 2020, 76
2108612 CIF
HKL
Mo O6 Pr2I -4 c 25.696; 5.696; 31.6796
90; 90; 90
1027.83Voronkova, Valentina I.; Antipin, Alexander M.; Sorokin, Timofei A.; Novikova, Nataliya E.; Kharitonova, Elena P.; Orlova, Ekaterina I.; Kvartalov, Vladimir B.; Presniakov, Mikhail Yu.; Bondarenko, Vladimir I.; Vasiliev, Alexander L.; Sorokina, Nataliya I.
Synthesis, structure and properties of layered Pr~2~MoO~6~-based oxymolybdates doped with Mg
Acta Crystallographica Section B, 2020, 76
2108613 CIF
HKL
Mg0.026 Mo0.974 O5.94 Pr2I -4 c 25.6979; 5.6979; 31.7012
90; 90; 90
1029.21Voronkova, Valentina I.; Antipin, Alexander M.; Sorokin, Timofei A.; Novikova, Nataliya E.; Kharitonova, Elena P.; Orlova, Ekaterina I.; Kvartalov, Vladimir B.; Presniakov, Mikhail Yu.; Bondarenko, Vladimir I.; Vasiliev, Alexander L.; Sorokina, Nataliya I.
Synthesis, structure and properties of layered Pr~2~MoO~6~-based oxymolybdates doped with Mg
Acta Crystallographica Section B, 2020, 76
2108614 CIF
HKL
Al Cu K O8 P2P 1 21/c 15.027; 14.047; 9.263
90; 102.29; 90
639.11Yakubovich, Olga; Kiriukhina, Galina; Shvanskaya, Larisa; Volkov, Anatoliy; Dimitrova, Olga
Joint crystallization of KCuAl[PO~4~]~2~ and K(Al,Zn)~2~[(P,Si)O~4~]~2~: crystal chemistry and mechanism of formation of phosphate-silicate epitaxial heterostructure
Acta Crystallographica Section B, 2020, 76
2108615 CIF
HKL
Al3 K2 O16 P3 Si ZnC 1 2/c 113.234; 13.121; 8.6581
90; 100.14; 90
1479.9Yakubovich, Olga; Kiriukhina, Galina; Shvanskaya, Larisa; Volkov, Anatoliy; Dimitrova, Olga
Joint crystallization of KCuAl[PO~4~]~2~ and K(Al,Zn)~2~[(P,Si)O~4~]~2~: crystal chemistry and mechanism of formation of phosphate-silicate epitaxial heterostructure
Acta Crystallographica Section B, 2020, 76
2108616 CIF
HKL
Ca2 H14 O23 P2 U3P b c a17.3785; 15.9864; 13.5477
90; 90; 90
3763.8Plášil, Jakub; Kiefer, Boris; Ghazisaeed, Seyedat; Philippo, Simon
Hydrogen bonding in the crystal structure of phurcalite, Ca~2~[(UO~2~)~3~O~2~(PO~4~)~2~]·7H~2~O: single-crystal X-ray study and TORQUE calculations
Acta Crystallographica Section B, 2020, 76
2108617 CIF
HKL
Ga105.3 Mg69.48 Ni48F d -3 m :219.8621; 19.8621; 19.8621
90; 90; 90
7835.7Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Rozdzynska-Kielbik, Beata; Cichowicz, Grzegorz; Cyranski, Michał K.; Chumak, Ihor; Ehrenberg, Helmut
New cubic cluster phases in the Mg‒Ni‒Ga system
Acta Crystallographica Section B, 2020, 76
2108618 CIF
HKL
Ga8 Mg24 Ni16F d -3 m :211.4886; 11.4886; 11.4886
90; 90; 90
1516.4Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Rozdzynska-Kielbik, Beata; Cichowicz, Grzegorz; Cyranski, Michał K.; Chumak, Ihor; Ehrenberg, Helmut
New cubic cluster phases in the Mg‒Ni‒Ga system
Acta Crystallographica Section B, 2020, 76
2108619 CIF
HKL
C13 H22 N2 O5P 1 21/c 19.8441; 10.8561; 13.5205
90; 96.728; 90
1435Li, Zihan; Yang, Pengpeng; Liu, Haodong; Liu, Jun; Zhu, Sha; Li, Xiaojie; Zhuang, Wei; Wu, Jinglan; Ying, Hanjie
Crystal forms and phase transformation of 1,5-pentanediamine-terephthalate: a bio-based nylon 5T monomer
Acta Crystallographica Section B, 2020, 76
2108620 CIF
HKL
C13 H20 N2 O4P -18.2881; 9.5302; 10.6708
113.46; 105.99; 99.162
707.87Li, Zihan; Yang, Pengpeng; Liu, Haodong; Liu, Jun; Zhu, Sha; Li, Xiaojie; Zhuang, Wei; Wu, Jinglan; Ying, Hanjie
Crystal forms and phase transformation of 1,5-pentanediamine-terephthalate: a bio-based nylon 5T monomer
Acta Crystallographica Section B, 2020, 76
2108621 CIF
HKL
C26 H31.34 N6 Ni2 O16.67P -110.1294; 12.2011; 14.243
82.035; 74.232; 79.373
1657.7Chahkandi, Mohammad; Keivanloo Shahrestanaki, Abolfazl; Mirzaei, Masoud; Nawaz Tahir, Muhammad; Mague, Joel T.
Crystal and molecular structure of [Ni{2-H~2~NC(=O)C~5~H~4~N}~2~(H~2~O)~2~][Ni{2,6-(O~2~C)~2~C~5~H~3~N}~2~]·4.67H~2~O; DFT studies on hydrogen bonding energies in the crystal
Acta Crystallographica Section B, 2020, 76
2108622 CIFC3 H18 F9 Gd O18 S3P 63/m13.7828; 13.7828; 7.3148
90; 90; 120
1203.39Janicki, Rafał; Starynowicz, Przemysław
Analysis of charge density in nonaaquagadolinium(III) trifluoromethanesulfonate – insight into Gd^III^—OH~2~ bonding
Acta Crystallographica Section B, 2020, 76
2108623 CIF
HKL
C23 H16 Ag2 N3 S16P -115.0062; 8.582; 13.3243
89.984; 91.447; 90.002
1715.4Foury-Leylekian, Pascale; Ilakovac, Vita; Fertey, Pierre; Baledent, Victor; Milat, Ognjen; Miyagawa, Kazuya; Kanoda, Kazushi; Hiramatsu, Takaaki; Yoshida, Yukihiro; Saito, Gunzi; Alemany, Pere; Canadell, Enric; Tomic, Silvia; Pouget, Jean-Paul
New insights into the structural properties of κ-(BEDT-TTF)~2~Ag~2~(CN)~3~ spin liquid
Acta Crystallographica Section B, 2020, 76
2108624 CIF
HKL
C23 H16 Ag2 N3 S16P -115.0831; 8.6447; 13.4755
90.012; 91.364; 89.998
1756.56Foury-Leylekian, Pascale; Ilakovac, Vita; Fertey, Pierre; Baledent, Victor; Milat, Ognjen; Miyagawa, Kazuya; Kanoda, Kazushi; Hiramatsu, Takaaki; Yoshida, Yukihiro; Saito, Gunzi; Alemany, Pere; Canadell, Enric; Tomic, Silvia; Pouget, Jean-Paul
New insights into the structural properties of κ-(BEDT-TTF)~2~Ag~2~(CN)~3~ spin liquid
Acta Crystallographica Section B, 2020, 76
2108625 CIF
HKL
C22 H17 F4 N OP 1 21 18.21; 6.33; 17.277
90; 102.41; 90
876.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108626 CIF
HKL
C22 H17 F4 N OP 1 21/c 19.705; 13.476; 13.843
90; 101.159; 90
1776.2Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108627 CIF
HKL
C22 H17 F4 N OP 1 21/c 19.642; 13.292; 13.931
90; 99.89; 90
1758.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108628 CIF
HKL
C22 H17 F4 N OP 1 21 18.317; 6.0774; 17.513
90; 103.095; 90
862.2Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108629 CIF
HKL
C22 H17 F4 N OP 1 21/c 113.366; 11.6008; 30.052
90; 130.787; 90
3528.1Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108630 CIF
HKL
C22 H17 F4 N OC 1 2/c 122.323; 13.499; 11.828
90; 98.459; 90
3525Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108631 CIF
HKL
C22 H17 F4 N OC 1 2/c 136.448; 6.1171; 16.087
90; 102.193; 90
3505.8Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108632 CIF
HKL
C22 H17 F4 N OP c a 2116.559; 17.595; 6.1048
90; 90; 90
1778.7Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108633 CIF
HKL
C22 H17 F4 N OP 1 21/c 19.445; 21.293; 9.59
90; 112.96; 90
1775.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108634 CIF
HKL
C22 H17 F4 N OC 1 2/c 136.079; 6.2372; 16.051
90; 104.627; 90
3494.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108635 CIF
HKL
C22 H17 F4 N OP 1 c 117.468; 6.2025; 16.338
90; 92.208; 90
1768.8Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108636 CIFC22 H17 F4 N OP 1 21/c 118.194; 6.147; 16.182
90; 104.903; 90
1748.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108637 CIF
HKL
C22 H17 F4 N OP 1 n 17.6714; 7.1287; 16.428
90; 100.298; 90
883.9Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108638 CIF
HKL
C22 H17 F4 N OP b c a16.643; 6.1042; 35.217
90; 90; 90
3577.8Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108639 CIF
HKL
C22 H17 F4 N OP 1 21/c 112.287; 11.3169; 22.191
90; 145.954; 90
1727.5Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108640 CIF
HKL
C22 H17 F4 N OP 1 21/c 112.947; 10.4113; 22.59
90; 145.306; 90
1733.2Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108641 CIFC22 H17 F4 N OP -111.137; 11.8983; 15.127
73.675; 71.73; 72.936
1779.74Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108642 CIF
HKL
C22 H17 F4 N OP -110.6975; 13.2186; 13.6339
68.667; 80.428; 81.09
1761.4Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108643 CIF
HKL
C22 H17 F4 N OP 1 21/c 111.322; 12.437; 20.012
90; 140.922; 90
1776.4Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108644 CIF
HKL
C22 H21 N OP b c a10.3744; 16.379; 19.851
90; 90; 90
3373.1Singla, Labhini; Yadav, Hare Ram; Roy Choudhury, Angshuman
Evaluation of fluorine-mediated intermolecular interactions in tetrafluorinated tetrahydroisoquinoline derivatives: synthesis and computational studies
Acta Crystallographica Section B, 2020, 76
2108645 CIF
HKL
Paper
C21 H16 N2 O4B 1 21 115.5993; 49.062; 15.6099
90; 119.896; 90
10357Nespolo, Massimo; Smaha, Rebecca W.; Parkin, Sean
Zero-obliquity twin lattice quasi-symmetry threefold twinning in 1-{(<i>R</i>)-1-[(3-oxo-2-isoindolinoyl)methyl]-2-propenyl}-5-methyl-2,3-indolinedione
Acta Crystallographica Section B, 2020, 76
2108646 CIF
HKL
Al3 B4 O12 SmC 1 2/c 17.2386; 9.3412; 11.1013
90; 103.224; 90
730.73Oreshonkov, A. S.; Shestakov, N. P.; Molokeev, M. S.; Aleksandrovsky, A. S.; Gudim, I. A.; Temerov, V. L.; Adichtchev, S. V.; Pugachev, A. M.; Nemtsev, I. V.; Pogoreltsev, E. I.; Denisenko, Y. G.
Monoclinic SmAl~3~(BO~3~)~4~: synthesis, structural and spectroscopic properties
Acta Crystallographica Section B, 2020, 76
2108647 CIFB4 Ca3 Eu2 O12P n m a7.20378; 15.57492; 8.63406
90; 90; 90
968.727Kosyl, Katarzyna M.; Paszkowicz, Wojciech; Shekhovtsov, Alexey N.; Kosmyna, Miron B.; Antonowicz, Jerzy; Olczak, Adam; Fitch, Andrew N.
Variation of cation distribution with temperature and its consequences on thermal expansion for Ca~3~Eu~2~(BO~3~)~4~
Acta Crystallographica Section B, 2020, 76, 554-562
2108648 CIF
Paper
B Fe2.654 Mg0.346 O5P b a m9.3914; 12.3034; 3.0697
90; 90; 90
354.69Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V.
Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis
Acta Crystallographica Section B, 2020, 76, 543-553
2108649 CIF
Paper
B Fe2.654 Mg0.346 O5P b a m9.425; 12.3528; 3.0799
90; 90; 90
358.58Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V.
Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis
Acta Crystallographica Section B, 2020, 76, 543-553
2108650 CIFC2 D10 O3 SP 1 21/c 16.30238; 9.05654; 11.22025
90; 105.969; 90
615.714Fortes, A. D.; Ponsonby, J.; Kirichek, O.; García-Sakai, V.
On the crystal structures and phase transitions of hydrates in the binary dimethyl sulfoxide–water system
Acta Crystallographica Section B, 2020, 76
2108651 CIFC2 D12 O4 SP 1 21/c 110.266194; 7.01113; 10.068968
90; 101.503; 90
710.183Fortes, A. D.; Ponsonby, J.; Kirichek, O.; García-Sakai, V.
On the crystal structures and phase transitions of hydrates in the binary dimethyl sulfoxide–water system
Acta Crystallographica Section B, 2020, 76

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