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2020797 CIF
HKL
Paper
C24 H32 Cl2 O2 Sc2P 1 21/n 19.3324; 10.754; 12.2892
90; 111.349; 90
1148.72Zhou, Zheng; Greenough, Joshua; Wei, Zheng; Petrukhina, Marina A.
The dinuclear scandium(III) cyclooctatetraenyl chloride complex di-μ-chlorido-bis[(η^8^-cyclooctatetraene)(tetrahydrofuran-κ<i>O</i>)scandium(III)]
Acta Crystallographica Section C, 2017, 73, 420-423
2020798 CIF
HKL
Paper
C33 H27 Br O6P -18.4269; 12.4905; 15.1415
66.53; 76.005; 85.473
1418.22Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020799 CIF
HKL
Paper
C34 H29 Br O6P -18.3989; 12.5415; 15.2195
67.408; 76.135; 85.458
1436.85Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020800 CIF
HKL
Paper
C35 H31 Br O6P -18.2587; 12.7841; 15.6238
66.446; 76.634; 86.03
1470.67Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020801 CIF
HKL
Paper
C8 H20 Mn O18 UP -16.997; 7.185; 11.043
106.356; 93.891; 115.13
470.9Ridenour, J. August; Pyrch, Mikaela M.; Manning, Zachery J.; Bertke, Jeffery A.; Cahill, Christopher L.
Two novel bimetallic transition metal‒uranyl one-dimensional coordination polymers with manganese(II) and cobalt(II) incorporating bridging diglycolate (2,2′-oxydiacetate) ligands
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020802 CIFC8 H20 Co O18 UP -16.997; 7.185; 11.043
106.356; 93.891; 115.13
470.9Ridenour, J. August; Pyrch, Mikaela M.; Manning, Zachery J.; Bertke, Jeffery A.; Cahill, Christopher L.
Two novel bimetallic transition metal‒uranyl one-dimensional coordination polymers with manganese(II) and cobalt(II) incorporating bridging diglycolate (2,2′-oxydiacetate) ligands
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020803 CIF
HKL
Paper
C22 H30 O9P 21 21 219.1605; 13.8069; 16.8625
90; 90; 90
2132.74Paz, Cristian; von Dossow, Daniela; Tiznado, Victor; Suarez, Sebastián; Cukiernik, Fabio D.; Baggio, Ricardo
A dihydro-β-agarofuran sesquiterpene from <i>Maytenus boaria</i>
Acta Crystallographica Section C, 2017, 73, 451-457
2020804 CIF
HKL
Paper
H20 Mg Na2 O18 Se2P 1 21/c 112.671; 6.61; 10.2706
90; 106.64; 90
824.19Kamburov, Stoyan; Schmidt, Horst; Voigt, Wolfgang; Balarew, Christo
Crystal structures of sodium magnesium selenate decahydrate, Na~2~Mg(SeO~4~)~2~·10H~2~O, a new selenate salt, and sodium magnesium selenate dihydrate, Na~2~Mg(SeO~4~)~2~·2H~2~O
Acta Crystallographica Section C, 2017, 73, 582-587
2020805 CIF
HKL
Paper
H4 Mg Na2 O10 Se2P -15.556; 5.923; 7.224
108.36; 99.07; 106.63
208Kamburov, Stoyan; Schmidt, Horst; Voigt, Wolfgang; Balarew, Christo
Crystal structures of sodium magnesium selenate decahydrate, Na~2~Mg(SeO~4~)~2~·10H~2~O, a new selenate salt, and sodium magnesium selenate dihydrate, Na~2~Mg(SeO~4~)~2~·2H~2~O
Acta Crystallographica Section C, 2017, 73, 582-587
2020806 CIF
HKL
Paper
C27 H32 N2 O3P 21 21 219.9801; 18.854; 26.1414
90; 90; 90
4918.9Kramer, Philipp; Bolte, Michael
Synthesis and crystal structures of two structurally related kryptoracemates
Acta Crystallographica Section C, 2017, 73, 575-581
2020807 CIF
HKL
Paper
C25.5 H29 Cl N2 O3P 110.1501; 14.8556; 17.662
109.248; 97.929; 91.214
2483.9Kramer, Philipp; Bolte, Michael
Synthesis and crystal structures of two structurally related kryptoracemates
Acta Crystallographica Section C, 2017, 73, 575-581
2020808 CIF
HKL
Paper
C9 H6 Br F N2 O4 SP -16.8884; 9.5036; 9.618
73.608; 87.634; 69.969
566.43Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D.
Supramolecular architectures in two 1:1 cocrystals of 5-fluorouracil with 5-bromothiophene-2-carboxylic acid and thiophene-2-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 481-485
2020809 CIF
HKL
Paper
C9 H7 F N2 O4 SP -16.8304; 7.0075; 12.3042
93.348; 103.091; 115.566
509.22Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D.
Supramolecular architectures in two 1:1 cocrystals of 5-fluorouracil with 5-bromothiophene-2-carboxylic acid and thiophene-2-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 481-485
2020810 CIF
HKL
Paper
C49 H37 Cl7 N4 O4 S4P -110.242; 11.807; 22.297
80.453; 84.916; 64.733
2404.1Wickham, Laura M.; Tanski, Joseph M.; Nadeau, Jocelyn M.
Crystal structure of a fluorescent C-shaped molecule containing closely stacked bithiophene-substituted quinoxaline rings
Acta Crystallographica Section C, 2017, 73, 276-279
2020811 CIF
HKL
Paper
C46 H40 Cl2 Co N16 O10P 1 21/n 19.54931; 16.1513; 14.5715
90; 91.2561; 90
2246.88Wang, Xue-Ru; Ma, Jian-Ping; Dong, Yu-Bin
Syntheses and structures of two new coordination polymers generated from a 4-aminotriazole-bridged organic ligand and Co^II^ salts
Acta Crystallographica Section C, 2017, 73, 247-253
2020812 CIF
HKL
Paper
C22 H16 Cl2 Co N8P 1 21/c 120.4923; 7.4278; 13.9819
90; 94.891; 90
2120.47Wang, Xue-Ru; Ma, Jian-Ping; Dong, Yu-Bin
Syntheses and structures of two new coordination polymers generated from a 4-aminotriazole-bridged organic ligand and Co^II^ salts
Acta Crystallographica Section C, 2017, 73, 247-253
2020813 CIF
HKL
Paper
C14 H21 N O4P 1 21 18.7136; 6.3606; 13.3613
90; 100.22; 90
728.78Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020814 CIF
HKL
Paper
C14 H21 N O4P 1 21 18.7007; 6.3466; 13.3458
90; 100.243; 90
725.21Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020815 CIF
HKL
Paper
C32 H55 O5.5C 1 2 129.0091; 7.7205; 29.9984
90; 114.524; 90
6112.5Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020816 CIF
HKL
Paper
C33 H57 O5.5P 1 21 117.9895; 8.2912; 22.7981
90; 108.343; 90
3227.7Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020817 CIF
HKL
Paper
C32 H54 O5P 1 21 110.91; 8.037; 17.018
90; 92.5; 90
1490.8Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020818 CIF
HKL
C10 H4 O9 Sr2C 1 2/c 18.1694; 17.2478; 7.7689
90; 97.521; 90
1085.25Trifa, Chahrazed; Mokhtari, Samia; Bouacida, Sofiane; Boudaren, Chaouki; Boudraa, Mhamed; Merazig, Hocine
A novel three-dimensional Sr^II^ coordination polymer based on benzene-1,2,4,5-tetracarboxylate: hydrothermal synthesis, crystal structure and spectroscopic and thermal studies
Acta Crystallographica Section C, 2017, 73, 369-375
2020819 CIF
HKL
Paper
C30 H44 Fe N10 O8P 1 21/c 18.73056; 11.7379; 17.619
90; 102.142; 90
1765.17Tanaka, Rikako; Matsushita, Nobuyuki
A charge-transfer salt composed of methyl viologen and hexacyanidoferrate(II)
Acta Crystallographica Section C, 2017, 73, 476-480
2020820 CIF
HKL
Paper
C22 H43 Cl Fe N O P3P 1 21/c 117.0243; 10.494; 15.1374
90; 109.09; 90
2555.6Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020821 CIF
HKL
Paper
C23 H39 Cl Fe N2 P2P 1 21/n 17.6074; 18.2229; 19.1442
90; 92.3658; 90
2651.7Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020822 CIF
HKL
Paper
C20 H34 Cl Fe N O2 P2P 1 21/c 113.7917; 14.6349; 11.2225
90; 90.729; 90
2265Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020823 CIF
HKL
Paper
C34 H26 Cd N2 O7P -18.073; 12.4019; 15.2718
106.744; 101.979; 96.647
1406.93Xie, Hua; Fang, Wang-Jian; Yao, Xiao-Qiang
A cadmium(II) coordination polymer with both polyrotaxane and polycatenane features constructed by a V-shaped semi-rigid ligand: synthesis and fluorescence properties
Acta Crystallographica Section C, 2017, 73, 541-545
2020824 CIF
HKL
Paper
C14 H12 F3 I3 N2P 1 21/c 17.9818; 26.7046; 9.222
90; 115.398; 90
1775.69Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020825 CIF
HKL
Paper
C19 H9 F3 I3 NP 1 21/c 110.5079; 12.5632; 15.1563
90; 102.49; 90
1953.47Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020826 CIF
HKL
Paper
C18 H8 F3 I3 N2P 1 21/c 18.6445; 14.0472; 15.8147
90; 97.662; 90
1903.25Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020827 CIF
HKL
Paper
C24 H18 Cu N2 O6P 1 21/c 111.731; 14.274; 13.211
90; 100.862; 90
2172.5Tang, Long; Zhang, Juan; Liu, Xiao-Xia; Wang, Ji-Jiang; Fu, Feng
A two-dimensional copper(II) coordination polymer based on 2,4′-oxybis(benzoate) and 4,4′-bipyridine
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020832 CIF
HKL
Paper
C38 H35 N O2 P2P 1 21 111.7931; 10.4209; 14.0792
90; 111.081; 90
1614.46Balogh, Szabolcs; Farkas, Gergely; Holczbauer, Tamás; Bakos, József
Origin of the chemical stability of phosphine-phosphoramidites: structural study of an UPPhos-type crystal and application of UPPhos in the asymmetric hydrogenation of imines
Acta Crystallographica Section C, 2017, 73
2020833 CIF
HKL
Paper
C15 H9 Cr F O3P 1 21/c 17.0166; 27.4725; 7.1101
90; 113.738; 90
1254.61Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020834 CIF
HKL
Paper
C15 H9 Cr F O3P 1 21/c 17.0616; 28.3503; 7.0571
90; 114.324; 90
1287.41Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020835 CIF
HKL
Paper
C12 H9 FF d d 212.9824; 23.0588; 5.7527
90; 90; 90
1722.1Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020836 CIF
HKL
Paper
C12 H9 FP b c n5.6462; 20.739; 7.292
90; 90; 90
853.9Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020837 CIF
HKL
C32 H36 Co N8 O8P 1 2/n 113.264; 9.0189; 14.709
90; 107.04; 90
1682.3Huang, Qiu-Ying; Zhao, Yang; Meng, Xiang-Ru
Syntheses, structures and characterization of isomorphous Co^II^and Ni^II^ coordination polymers based on 2-[(1<i>H</i>-imidazol-1-yl)methyl]-6-methyl-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate
Acta Crystallographica Section C, 2017, 73, 645-651
2020838 CIF
HKL
C32 H36 N8 Ni O8P 1 2/n 113.192; 9.018; 14.67
90; 106.84; 90
1670.4Huang, Qiu-Ying; Zhao, Yang; Meng, Xiang-Ru
Syntheses, structures and characterization of isomorphous Co^II^and Ni^II^ coordination polymers based on 2-[(1<i>H</i>-imidazol-1-yl)methyl]-6-methyl-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate
Acta Crystallographica Section C, 2017, 73, 645-651
2020840 CIF
HKL
Paper
C22 H28 O7P 1 21/c 14.9801; 17.4771; 23.1
90; 94.124; 90
2005.37Wiedemann, Dennis; Kohl, Julia
Invariom-model refinement and Hirshfeld surface analysis of well-ordered solvent-free dibenzo-21-crown-7
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020841 CIF
HKL
Paper
C22 H28 O7P 1 21/c 14.9801; 17.4771; 23.1
90; 94.124; 90
2005.37Wiedemann, Dennis; Kohl, Julia
Invariom-model refinement and Hirshfeld surface analysis of well-ordered solvent-free dibenzo-21-crown-7
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020842 CIF
HKL
Paper
C6 F3 I3P 1 21/c 19.3455; 13.1854; 9.2185
90; 118.466; 90
998.61Raffo, Pablo A.; Suárez, Sebastián; Fantoni, Adolfo C.; Baggio, Ricardo; Cukiernik, Fabio D.
Polymorphism of a widely used building block for halogen-bonded assemblies: 1,3,5-trifluoro-2,4,6-triiodobenzene
Acta Crystallographica Section C, 2017, 73
2020843 CIF
HKL
Paper
C24 H28 N6 O4P c c n9.1077; 13.5893; 19.476
90; 90; 90
2410.5Martin, Kenneth L.; Breton, Gary W.
Computational, ^1^H NMR, and X-ray structural studies on 1-arylurazole tetrazane dimers
Acta Crystallographica Section C, 2017, 73
2020844 CIF
HKL
Paper
C12 H11 Cl N3 O PP 3 c 115.8635; 15.8635; 8.9754
90; 90; 120
1956.06Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Ghorbanian, Nazila; Andreev, Pavel V.
A novel tubular hydrogen-bond pattern in a new diazaphosphole oxide: a combination of X-ray crystallography and theoretical study of hydrogen bonds
Acta Crystallographica Section C, 2017, 73, 508-516
2020845 CIF
HKL
Paper
C28 H20 N18 ZnP -18.4211; 9.5379; 9.7491
83.531; 66.048; 85.922
710.78Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020846 CIF
HKL
Paper
C28 H20 Cd N18P -18.7209; 8.7949; 10.349
91.966; 94.945; 112.682
727.67Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020847 CIF
HKL
Paper
C32 H20 Cd N18P -19.271; 9.571; 10.156
87.833; 68.383; 88.803
837.2Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020848 CIF
HKL
Paper
C78 H91 Fe K N10 O8P 1 21/c 113.0866; 21.934; 24.898
90; 91.214; 90
7145.2Wu, Qi; Yao, Zhen; Li, Jianfeng
Synthesis and characterization of (cryptand-222)potassium (2-methylimidazolato)(<i>meso</i>-tetraphenylporphinato)ferrate(II)–2-methylimidazole–tetrahydrofuran (1/1/2)
Acta Crystallographica Section C, 2017, 73
2020849 CIF
HKL
Paper
C20 H18 Cl2 N4 PtP 1 21/c 110.6134; 15.7166; 11.8754
90; 100.376; 90
1948.5DeStefano, Matthew R.; Geiger, David K.
A luminescent bis(pyridyl)-substituted benzimidazole platinum(II) complex exhibiting an intermolecular anagostic interaction
Acta Crystallographica Section C, 2017, 73
2020850 CIF
HKL
Paper
C28 H30 Cl2 Cu N6 O13C 1 2/c 148.675; 8.375; 16.3155
90; 100.716; 90
6535.1Bhat, Satish S.; Revankar, Vidyanand K.; Shivalingegowda, Naveen; Lokanath, N. K.
A fluorophore-labelled copper complex: crystal structure, hybrid cyclic water‒perchlorate cluster and biological properties
Acta Crystallographica Section C, 2017, 73
2020851 CIF
HKL
Paper
C50 H34 Cl2 N4 O14 Zn2P 1 21/n 110.6003; 14.0573; 15.8141
90; 104.016; 90
2286.33Sorenson, Shayne; Popova, Marina; Arif, Atta M.; Berreau, Lisa M.
A bipyridine-ligated zinc(II) complex with bridging flavonolate ligation: synthesis, characterization, and visible-light-induced CO release reactivity
Acta Crystallographica Section C, 2017, 73
2020852 CIF
HKL
Paper
C20 H24 Br4 Cd Hg N2 O5P 1 21/c 17.3985; 16.498; 22.9089
90; 98.3739; 90
2766.5Truong, Khai-Nghi; Merkens, Carina; Englert, Ulli
3-(Pyridin-4-yl)acetylacetone: Cd^II^ and Hg^II^ compete for nitrogen coordination
Acta Crystallographica Section C, 2017, 73
2020853 CIF
HKL
Paper
C21 H25 Cl O5 SP 21 21 215.3945; 9.1577; 43.475
90; 90; 90
2147.7Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
Acta Crystallographica Section C, 2017, 73
2020854 CIF
HKL
Paper
C21 H27 Cl O6 SP 21 21 214.4659; 9.8994; 48.073
90; 90; 90
2125.3Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
Acta Crystallographica Section C, 2017, 73
2020855 CIF
HKL
Paper
C25 H28 Fe N4 O5P 1 21/n 110.3583; 13.1393; 17.7722
90; 92.291; 90
2416.88Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1)
Acta Crystallographica Section C, 2017, 73
2020856 CIF
HKL
C17 H18 Cl Fe N3 O2I 1 2/a 120.8783; 7.4013; 23.2605
90; 108.146; 90
3415.6Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1)
Acta Crystallographica Section C, 2017, 73
2020857 CIF
HKL
Paper
C13 H11 Cd N3 O7C 1 2/c 116.56; 13.383; 13.302
90; 111.47; 90
2743.5Zhou, Qian-Kun; Li, Ni-Ya
A three-dimensional cadmium coordination polymer based on 1,4-bis(1,2,4-triazol-1-yl)but-2-ene and benzene-1,3,5-tricarboxylic acid
Acta Crystallographica Section C, 2017, 73
2020898 CIF
HKL
Paper
C5 H7 N3P b c a5.1217; 9.8397; 21.914
90; 90; 90
1104.4Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
A new polymorph of 2,6-diaminopyridine
Acta Crystallographica Section C, 2017, 73, 990-993
2020899 CIF
HKL
Paper
C6 H8 N2P 1 21/c 14.5031; 6.586; 10.572
90; 96.54; 90
311.5Seidel, Rüdiger W.; Goddard, Richard; Nöthling, Nils; Lehmann, Christian W.
Adiponitrile at 100K
Acta Crystallographica Section C, 2017, 73, 937-940
2020900 CIF
HKL
Paper
C13 H13 N3 O SP -18.4341; 8.6991; 10.1083
91.249; 113.506; 110.292
626.74Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020901 CIF
HKL
Paper
C26 H24 Cu N8 O9 S2P b c n18.1534; 7.1814; 21.8523
90; 90; 90
2848.82Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020902 CIF
HKL
Paper
C26 H26 Au Cl3 N6 O3 S2P -110.0052; 12.594; 12.9412
111.867; 97.271; 99.755
1459.04Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020903 CIF
HKL
Paper
C10 H12 Cl3 K O2 PtP 1 21/c 112.0312; 16.1528; 8.1007
90; 107.295; 90
1503.09Nguyen Thi Thanh, Chi; Truong Thi Cam, Mai; Pham Van, Thong; Nguyen, Long; Nguyen Ha, My; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity of platinum(II) complexes containing eugenol and a quinolin-8-ol-derived chelator
Acta Crystallographica Section C, 2017, 73, 1030-1037
2020904 CIF
HKL
Paper
C19 H16 Cl3 N O3 PtP -18.1313; 11.296; 11.4294
88.793; 76.567; 70.219
958.93Nguyen Thi Thanh, Chi; Truong Thi Cam, Mai; Pham Van, Thong; Nguyen, Long; Nguyen Ha, My; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity of platinum(II) complexes containing eugenol and a quinolin-8-ol-derived chelator
Acta Crystallographica Section C, 2017, 73, 1030-1037
2020905 CIF
HKL
Paper
C6 H28 N12 Ni2 O8P -17.1226; 9.0134; 9.1203
103.16; 107.48; 106.69
502.4Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020906 CIF
HKL
Paper
C3 H11 Cu N5 O4P -17.2183; 7.4079; 9.887
72.45; 68.82; 62.74
432.3Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020907 CIF
HKL
Paper
C3 H29 Co2 N11 O11P 1 21/n 17.0765; 12.676; 20.591
90; 98.7; 90
1825.8Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020908 CIF
HKL
Paper
C7 H8 B F3 N2 O3P 1 21/c 111.5305; 8.2823; 11.502
90; 118.304; 90
967.11Kopczyńska, Karolina; Marek, Paulina H.; Banaś, Bartłomiej; Madura, Izabela D.
Synthon preference in the cocrystal of 3,4,5-trifluorophenylboronic acid with urea
Acta Crystallographica Section C, 2017, 73, 889-895
2020909 CIF
HKL
C3 B Li0.96P -6 m 22.5408; 2.5408; 7.5989
90; 90; 120
42.484Milashius, Viktoria; Pavlyuk, Volodymyr; Kluziak, Karolina; Dmytriv, Grygoriy; Ehrenberg, Helmut
LiBC~3~: a new borocarbide based on graphene and heterographene networks
Acta Crystallographica Section C, 2017, 73, 984-989
2020910 CIF
Paper
C24 H17 Cl2 F3 N3 O6 Re S2P -18.596; 11.217; 15.161
92.88; 104.12; 91.19
1415.06Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020911 CIF
HKL
Paper
C27 H17 F3 N3 O6.28 Re S2P 1 21/n 112.814; 12.088; 18.248
90; 96.56; 90
2808Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020912 CIF
HKL
Paper
C23 H15 F3 N3 O6 Re SP 1 21/n 112.398; 12.878; 15.393
90; 91.83; 90
2456.4Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020913 CIF
HKL
Paper
C25 H17 Cu F6 N O5P -110.5928; 10.7082; 12.4943
69.019; 71.705; 88.11
1251.32Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020914 CIF
HKL
Paper
C30 H22 Cu F6 N2 O6P 1 21/c 110.0085; 14.154; 11.2503
90; 110.022; 90
1497.4Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020915 CIF
HKL
Paper
C30 H22 Cu F6 N2 O8P -17.595; 9.6764; 10.7507
108.71; 101.727; 93.65
725.61Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020916 CIF
HKL
Paper
C19 H22 Cd N10P -17.3585; 8.796; 17.619
79.56; 84.69; 78.96
1098.8Lu, Yang; Liao, Wei-Qiang; Hua, Xiu-Ni
A new two-dimensional polymeric cadmium(II) complex containing dicyanamide bridging ligands
Acta Crystallographica Section C, 2017, 73, 885-888
2020917 CIF
HKL
Paper
C12 H15 N O2P b c a9.207; 8.21; 28.27
90; 90; 90
2136.91Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020918 CIF
HKL
Paper
C13 H17 N O2P b c a10.627; 9.249; 24.623
90; 90; 90
2420.17Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020919 CIF
HKL
Paper
C14 H17 N O2P 1 21/c 114.294; 11.448; 16.112
90; 110.158; 90
2475Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020920 CIF
HKL
Paper
C13 H13 Cl2 N3 O3P -19.3874; 10.5102; 15.4295
71.167; 83.335; 87.73
1431.09Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020921 CIF
HKL
Paper
C13 H13 Cl2 N3 O3P 1 21/c 124.7483; 6.9525; 18.1423
90; 111.5; 90
2904.4Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020922 CIF
HKL
Paper
C11 H13 N3 O4 SP 1 21/n 16.7335; 7.6307; 25.0638
90; 93.928; 90
1284.79Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020923 CIF
HKL
Paper
Cs3 Li O16 W4 Zn2I -4 3 d12.2643; 12.2643; 12.2643
90; 90; 90
1844.71Solodovnikov, Sergey F.; Solodovnikova, Zoya A.; Zolotova, Evgeniya S.; Kadyrova, Yulia M.; Savina, Aleksandra A.; Stefanovich, Sergey Yu.; Khaikina, Elena G.
Cs~3~LiZn~2~(WO~4~)~4~ and Rb~3~Li~2~Ga(MoO~4~)~4~: different filled derivatives of the cation-deficient Cs~6~Zn~5~(MoO~4~)~8~ structure
Acta Crystallographica Section C, 2017, 73, 946-952
2020924 CIF
HKL
Paper
Ga Li2 Mo4 O16 Rb3I -4 2 d11.8635; 11.8635; 11.8932
90; 90; 90
1673.88Solodovnikov, Sergey F.; Solodovnikova, Zoya A.; Zolotova, Evgeniya S.; Kadyrova, Yulia M.; Savina, Aleksandra A.; Stefanovich, Sergey Yu.; Khaikina, Elena G.
Cs~3~LiZn~2~(WO~4~)~4~ and Rb~3~Li~2~Ga(MoO~4~)~4~: different filled derivatives of the cation-deficient Cs~6~Zn~5~(MoO~4~)~8~ structure
Acta Crystallographica Section C, 2017, 73, 946-952
2020925 CIF
HKL
Paper
C69.27 H64.81 O16.14P -112.519; 12.594; 19.975
80.12; 89.69; 68.02
2871.2Vinokur, Anastasiya I.; White, Paul B.; Fotsing, Maurice Tagatsing; Arderne, Charmaine; Ndinteh, Derek Tantoh; Vestling, Martha M.; Guzei, Ilia A.
Deciphering composition and connectivity of a natural product with the assistance of MS and 2D NMR
Acta Crystallographica Section C, 2017, 73, 994-1002
2020926 CIF
HKL
Paper
C18 H15 Br O5P 1 21/n 111.96; 9.025; 14.981
90; 96.768; 90
1605.8Li, Ning; Yao, Binrong; Wang, Chunhua; Meng, Qingguo; Hou, Guige
Synthesis, crystal structure and activity evaluation of novel 3,4-dihydro-1-benzoxepin-5(2<i>H</i>)-one derivatives as protein–tyrosine kinase (PTK) inhibitors
Acta Crystallographica Section C, 2017, 73, 1003-1009
2020927 CIF
HKL
Paper
C8 H10 F Na O5P 1 21/n 15.4784; 5.9139; 30.379
90; 92.54; 90
983.27Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020928 CIF
HKL
Paper
C8 H6 F K O3P 1 21/c 118.3542; 6.9466; 6.5969
90; 92.995; 90
839.95Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020929 CIF
HKL
Paper
C8 H6 F O3 RbP 1 21/c 118.0011; 7.1625; 6.8548
90; 91.995; 90
883.27Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020930 CIF
HKL
Paper
C21 H15 Ag N2 O6P 1 21/n 18.4981; 17.669; 12.658
90; 100.95; 90
1866Chen, Jing-Min; Zhou, Qian-Kun; Hou, Yi-Xuan; Liu, Dong
Construction and photocatalytic properties of two metal-mediated coordination polymers based on benzene-1,3,5-tricarboxylic acid and <i>trans</i>-1-(pyridin-3-yl)-2-(pyridin-4-yl)ethene
Acta Crystallographica Section C, 2017, 73, 1017-1023
2020931 CIF
HKL
Paper
C21 H16 Cd N2 O7P -19.4176; 9.861; 12.269
91.11; 103.34; 117.23
975.4Chen, Jing-Min; Zhou, Qian-Kun; Hou, Yi-Xuan; Liu, Dong
Construction and photocatalytic properties of two metal-mediated coordination polymers based on benzene-1,3,5-tricarboxylic acid and <i>trans</i>-1-(pyridin-3-yl)-2-(pyridin-4-yl)ethene
Acta Crystallographica Section C, 2017, 73, 1017-1023
2020932 CIF
HKL
Paper
C19 H35 N P2P 1 2/c 116.2905; 6.751; 18.9112
90; 98.2024; 90
2058.52Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020933 CIF
HKL
Paper
C19 H35 Cl2 Fe N P2P -18.2907; 10.7222; 13.6434
87.0826; 80.8448; 75.7315
1160.35Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020934 CIF
HKL
Paper
C19 H35 Cl2 Co N P2P -18.2603; 10.722; 13.6314
86.8728; 80.5491; 75.6607
1153.68Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020935 CIF
HKL
Paper
C22 H35 Br Mn N O3 P2P 1 21/n 110.6732; 15.6935; 15.1651
90; 96.0732; 90
2525.9Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020936 CIF
HKL
Paper
C20 H22 Cd N2 O5P -18.7119; 10.318; 10.961
83.47; 82.91; 84.71
968.3Hou, Yi-Xuan; Liu, Dong
A three-dimensional supramolecular framework based on the interlinkage of an interpenetrating diamondoid coordination network
Acta Crystallographica Section C, 2017, 73, 869-873
2020937 CIF
HKL
Paper
C27 H28 N6 O6 PtP -110.264; 12.066; 13.382
98.7061; 110.591; 113.591
1336.8Kiwada, Tatsuto; Takayama, Hiroshi; Hirasaki, Aika; Ogawa, Kazuma; Odani, Akira
Asymmetric structure of <i>cis</i>-[<i>N</i>-(9-anthracenylmethyl)-1,2-ethanediamine]dipyridineplatinum(II) dinitrate
Acta Crystallographica Section C, 2017, 73, 975-978
2020938 CIF
HKL
Paper
C11 H7 Co Cu4 N26 OP n m a12.3459; 15.9301; 14.7454
90; 90; 90
2900Qin, Ying-Lian; Qin, Jian-Fang; Sun, Hong
A novel tetrazolate- and cyanide-bridged three-dimensional heterometallic coordination polymer: crystal structure, thermal stability and magnetic properties
Acta Crystallographica Section C, 2017, 73, 968-974
2020939 CIF
Paper
C25 H29 Cu F6 N3 O8 S2P -18.8133; 11.8; 15.404
96.363; 93.886; 105.518
1526.1Sivanesan, Dharmalingam; Youn, Min Hye; Park, Ki Tae; Kim, Hak Joo; Grace, Andrews Nirmala; Jeong, Soon Kwan
Mono- and dinuclear Cu^II^ complexes of the benzyldipicolylamine (BDPA) ligand: crystal structure, synthesis and characterization
Acta Crystallographica Section C, 2017, 73, 1024-1029
2020940 CIF
Paper
C42 H38 Cu2 F12 N6 O12 S4P -18.8793; 10.5542; 14.162
103.357; 94.115; 102.742
1248.9Sivanesan, Dharmalingam; Youn, Min Hye; Park, Ki Tae; Kim, Hak Joo; Grace, Andrews Nirmala; Jeong, Soon Kwan
Mono- and dinuclear Cu^II^ complexes of the benzyldipicolylamine (BDPA) ligand: crystal structure, synthesis and characterization
Acta Crystallographica Section C, 2017, 73, 1024-1029
2020941 CIF
HKL
Paper
C6 H20 N22 O2P 1 21/c 112.231; 3.919; 17.968
90; 92.949; 90
860.1Liu, Qing; Chen, Xiang; Cao, Wenli; Yang, Jin; Zhang, Wenhui; Ren, Yinghui; Ma, Haixia; Zhao, Fengqi; Hu, Rongzu
The synthesis, crystal structure and thermal properties of an energetic compound: the hydrated azanium salt of 3,6-bis[(1<i>H</i>-1,2,3,4-tetrazol-5-yl)amino]-1,2,4,5-tetrazine
Acta Crystallographica Section C, 2017, 73, 941-945

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