Crystallography Open Database

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2022585 CIF
HKL
Paper
C28 H36 N6 O4P 1 21/c 19.77352; 19.3316; 14.3425
90; 90.3045; 90
2709.8Grosu, Ioana Georgeta; Martin, Flavia; Turza, Alexandru; Miclaus, Maria; Kacso, Irina; Borodi, Gheorghe
Structural studies of various olmesartan solvates
Acta Crystallographica Section C, 2022, 78
2022586 CIF
HKL
Paper
C28 H36 N6 O5P 1 21/c 110.25267; 19.21448; 14.29015
90; 90.1353; 90
2815.15Grosu, Ioana Georgeta; Martin, Flavia; Turza, Alexandru; Miclaus, Maria; Kacso, Irina; Borodi, Gheorghe
Structural studies of various olmesartan solvates
Acta Crystallographica Section C, 2022, 78
2022587 CIF
HKL
Paper
C25 H27 Cl3 N6 O3P 1 21/c 110.0422; 18.3553; 14.4134
90; 91.5895; 90
2655.77Grosu, Ioana Georgeta; Martin, Flavia; Turza, Alexandru; Miclaus, Maria; Kacso, Irina; Borodi, Gheorghe
Structural studies of various olmesartan solvates
Acta Crystallographica Section C, 2022, 78
2022588 CIF
HKL
Paper
C26 H29 N7 O3P 1 21/c 19.92522; 17.86566; 14.34306
90; 91.437; 90
2542.52Grosu, Ioana Georgeta; Martin, Flavia; Turza, Alexandru; Miclaus, Maria; Kacso, Irina; Borodi, Gheorghe
Structural studies of various olmesartan solvates
Acta Crystallographica Section C, 2022, 78
2022589 CIF
HKL
Paper
C58 H76 N6 S3P 1 21/c 126.461; 21.2115; 9.2552
90; 90.044; 90
5194.73Li, Gongchun; Wang, Wei; Zhan, Chun; Xiao, Shengqiang
Synthesis and properties of a novel decacyclic <i>S</i>,<i>N</i>-heteroacene
Acta Crystallographica Section C, 2022, 78
2022590 CIF
HKL
Paper
C12 H16 O4P 21 21 214.9935; 7.1864; 33.3673
90; 90; 90
1197.4Zhang, Qun-Zheng; Zhong, Zhen-Hua; Hao, Ding; Feng, Ming-Nan; Wang, Si-Chang; Han, Qi-Long; Bai, Yajun; Xu, Danni; Liao, Sha; Xiao, Chaoni; Zhang, Xun-Li; Zheng, Xiaohui
Synthesis, crystal structure and bioactivities of α-asaronol
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022591 CIF
Paper
Ca10.974 O27.64 P6.012P 19.449; 9.449; 6.908
90; 90; 120
534.14Arnold, Emily L.; Keeble, Dean S.; Evans, J. P. O.; Greenwood, Charlene; Rogers, Keith D.
Investigating pair distribution function use in analysis of nanocrystalline hydroxyapatite and carbonate-substituted hydroxyapatite
Acta Crystallographica Section C, 2022, 78
2022592 CIF
Paper
C16 H15 N3 O3P -110.0118; 11.8026; 13.6496
65.234; 73.354; 78.437
1397.18González-González, Juan Saulo; Valiente Flores, Miguel Eulalio; Flores-Alamo, Marco; López-Macías, Elizabeth; Martínez-Martínez, Francisco Javier; García-Ortega, Héctor
Crystal structures of cocrystals of 2,7-dihydroxynaphthalene with isoniazid and piracetam
Acta Crystallographica Section C, 2022, 78
2022593 CIF
Paper
C16 H18 N2 O4P c a 2113.6888; 11.037; 9.6269
90; 90; 90
1454.46González-González, Juan Saulo; Valiente Flores, Miguel Eulalio; Flores-Alamo, Marco; López-Macías, Elizabeth; Martínez-Martínez, Francisco Javier; García-Ortega, Héctor
Crystal structures of cocrystals of 2,7-dihydroxynaphthalene with isoniazid and piracetam
Acta Crystallographica Section C, 2022, 78
2022594 CIF
HKL
Paper
Cu Na2 Ni O8 P2P 1 21/n 15.13; 8.6729; 6.8473
90; 97.104; 90
302.311Kiriukhina, Galina V.; Yakubovich, Olga V.; Verchenko, Polina A.; Volkov, Anatoly S.; Dimitrova, Olga V.
Novel first-row transition-metal phosphates: hydrothermal synthesis and crystal structures
Acta Crystallographica Section C, 2022, 78
2022595 CIF
HKL
Paper
Cu Mn2 O8 P2P -14.8292; 5.4051; 6.5968
72.716; 86.579; 69.064
153.35Kiriukhina, Galina V.; Yakubovich, Olga V.; Verchenko, Polina A.; Volkov, Anatoly S.; Dimitrova, Olga V.
Novel first-row transition-metal phosphates: hydrothermal synthesis and crystal structures
Acta Crystallographica Section C, 2022, 78
2022596 CIF
HKL
Paper
C24 H588 Ce6 Mo124 N4 Na4 O664C 1 2/c 154.272; 38.896; 31.734
90; 112.145; 90
62048Al-Sayed, Emir; Tanuhadi, Elias; Giester, Gerald; Rompel, Annette
Synthesis and characterization of the `Japanese rice-ball'-shaped Molybdenum Blue Na~4~[Mo~2~O~2~(OH)~4~(C~6~H~4~NO~2~)~2~]~2~[Mo~120~Ce~6~O~366~H~12~(OH)~2~(H~2~O)~76~]∼ 200H~2~O
Acta Crystallographica Section C, 2022, 78
2022597 CIF
Paper
C4 H10 Ce Cl O9P 1 21 15.9097; 7.7974; 11.7206
90; 97.816; 90
535.07Belhouas, Ratiba; Trifa, Chahrazed; Bouacida, Sofiane; Benmerad, Belkacem; Souici, Abdel Hafid; Boudaren, Chaouki; Merazig, Hocine
A new chiral rare-earth organic framework constructed by tartaric acid: synthesis, structural, thermal investigations and optical properties
Acta Crystallographica Section C, 2022, 78, 314-321
2022600 CIF
HKL
Paper
C3 H5 Cl O3P 1 21/c 110.8897; 10.6951; 9.0496
90; 108.059; 90
1002.05Gordon, Matthew N.; Liu, Yanyao; Shafei, Ibrahim H.; Brown, M. Kevin; Skrabalak, Sara E.
Crystal structures of three β-halolactic acids: hydrogen bonding resulting in differing <i>Z</i>'
Acta Crystallographica Section C, 2022, 78, 257-264
2022601 CIF
HKL
Paper
C3 H5 Br O3P 1 21/c 111.3076; 10.8912; 9.0769
90; 106.673; 90
1070.85Gordon, Matthew N.; Liu, Yanyao; Shafei, Ibrahim H.; Brown, M. Kevin; Skrabalak, Sara E.
Crystal structures of three β-halolactic acids: hydrogen bonding resulting in differing <i>Z</i>'
Acta Crystallographica Section C, 2022, 78, 257-264
2022602 CIF
HKL
Paper
C3 H5 I O3P 1 21/c 111.4762; 5.437; 9.1941
90; 92.848; 90
572.97Gordon, Matthew N.; Liu, Yanyao; Shafei, Ibrahim H.; Brown, M. Kevin; Skrabalak, Sara E.
Crystal structures of three β-halolactic acids: hydrogen bonding resulting in differing <i>Z</i>'
Acta Crystallographica Section C, 2022, 78, 257-264
2022603 CIF
HKL
Paper
C11 H17 Cl N2 O2P b c a8.77; 11.658; 23.843
90; 90; 90
2437.7van Terwingen, Steven; Ebel, Ben; Wang, Ruimin; Englert, Ulli
Weaving a 2D net of hydrogen and halogen bonds: cocrystal of a pyrazolium bromide with tetrafluorodiiodobenzene
Acta Crystallographica Section C, 2022, 78
2022604 CIF
HKL
Paper
C11 H17 Br N2 O2P b c a8.859; 12.038; 23.805
90; 90; 90
2538.7van Terwingen, Steven; Ebel, Ben; Wang, Ruimin; Englert, Ulli
Weaving a 2D net of hydrogen and halogen bonds: cocrystal of a pyrazolium bromide with tetrafluorodiiodobenzene
Acta Crystallographica Section C, 2022, 78
2022605 CIF
HKL
Paper
C14 H19 Br F2 I N2 O3P 1 21/c 112.9151; 11.3061; 12.5239
90; 90.6281; 90
1828.62van Terwingen, Steven; Ebel, Ben; Wang, Ruimin; Englert, Ulli
Weaving a 2D net of hydrogen and halogen bonds: cocrystal of a pyrazolium bromide with tetrafluorodiiodobenzene
Acta Crystallographica Section C, 2022, 78
2022606 CIF
HKL
Paper
C18 H28 N4 O2P b c a6.9163; 12.5609; 19.9264
90; 90; 90
1731.11Ranaweera, Samantha A.; Bruno, Donnadieu; Henry, W. P.; White, Mark. G.
Step-stool conformation of a cyclic Schiff base derived from ethylenediamine and heptane-2,4,6-trione: evidence for partial hydrolysis in metal coordination
Acta Crystallographica Section C, 2022, 78
2022607 CIF
HKL
Paper
C18 H14 Cl4 N2 OP 1 21/c 17.1902; 18.5341; 14.2507
90; 102.814; 90
1851.81Kaspiaruk, Hanna; Checińska, Lilianna
A comparison of three crystalline forms of miconazole: solvent-free, ethanol monosolvate and hemihydrate
Acta Crystallographica Section C, 2022, 78
2022608 CIF
HKL
Paper
C20 H20 Cl4 N2 O2P -18.0766; 11.5926; 13.0383
115.423; 99.068; 94.776
1073.06Kaspiaruk, Hanna; Checińska, Lilianna
A comparison of three crystalline forms of miconazole: solvent-free, ethanol monosolvate and hemihydrate
Acta Crystallographica Section C, 2022, 78
2022609 CIF
HKL
Paper
C18 H15 Cl4 N2 O1.5P 1 21/c 18.063; 33.261; 16.5481
90; 117.864; 90
3923.4Kaspiaruk, Hanna; Checińska, Lilianna
A comparison of three crystalline forms of miconazole: solvent-free, ethanol monosolvate and hemihydrate
Acta Crystallographica Section C, 2022, 78
2022610 CIF
HKL
Paper
C28 H20 O5 P ReP -19.9301; 10.1686; 12.7882
80.948; 71.899; 88.682
1211.6Schutte-Smith, Marietjie; Visser, Hendrik Gideon
Crystal and molecular structures of <i>fac</i>-[Re(Bid)(PPh~3~)(CO)~3~] [Bid is tropolone (TropH) and tribromotropolone (TropBr~3~H)]
Acta Crystallographica Section C, 2022, 78
2022611 CIF
HKL
Paper
C28 H17 Br3 O5 P ReP -18.5413; 8.7024; 20.376
102.221; 93.891; 109.093
1383.3Schutte-Smith, Marietjie; Visser, Hendrik Gideon
Crystal and molecular structures of <i>fac</i>-[Re(Bid)(PPh~3~)(CO)~3~] [Bid is tropolone (TropH) and tribromotropolone (TropBr~3~H)]
Acta Crystallographica Section C, 2022, 78
2022612 CIF
HKL
Paper
C18 H15 Ag Cl3 F3 N2 O7 SP 1 21/n 114.987; 10.835; 15.997
90; 100.49; 90
2554.2Jo, Seong Min; Noh, Tae Hwan
Solvent media as the driving force in the formation of one-dimensional silver(I) coordination polymers with 2-methylidene-1,3-bis(nicotinoyloxy)propane
Acta Crystallographica Section C, 2022, 78
2022613 CIF
HKL
Paper
C17 H14 Ag F3 N2 O7 SP 1 21/c 18.4347; 15.5581; 14.9879
90; 100.31; 90
1935.07Jo, Seong Min; Noh, Tae Hwan
Solvent media as the driving force in the formation of one-dimensional silver(I) coordination polymers with 2-methylidene-1,3-bis(nicotinoyloxy)propane
Acta Crystallographica Section C, 2022, 78
2022614 CIF
HKL
Paper
C20 H28 Cl O2.5P 31 2 110.5989; 10.5989; 28.4478
90; 90; 120
2767.58Turza, Alexandru; Ulici, Adelina; Muresan-Pop, Marieta; Borodi, Gheorghe
Solid forms and β-cyclodextrin complexation of turinabol
Acta Crystallographica Section C, 2022, 78, 305-313
2022615 CIF
HKL
Paper
C20 H27 Cl O2P 1 21 110.8409; 10.225; 16.4751
90; 93.759; 90
1822.31Turza, Alexandru; Ulici, Adelina; Muresan-Pop, Marieta; Borodi, Gheorghe
Solid forms and β-cyclodextrin complexation of turinabol
Acta Crystallographica Section C, 2022, 78, 305-313
2022616 CIF
HKL
Paper
C42 H60 Cl2 O7P 43 21 210.70311; 10.70311; 68.7275
90; 90; 90
7873.19Turza, Alexandru; Ulici, Adelina; Muresan-Pop, Marieta; Borodi, Gheorghe
Solid forms and β-cyclodextrin complexation of turinabol
Acta Crystallographica Section C, 2022, 78, 305-313
2022617 CIF
HKL
Paper
C42 H57 Cl2 F3 O5P 21 21 2110.3088; 12.9337; 29.6661
90; 90; 90
3955.41Turza, Alexandru; Ulici, Adelina; Muresan-Pop, Marieta; Borodi, Gheorghe
Solid forms and β-cyclodextrin complexation of turinabol
Acta Crystallographica Section C, 2022, 78, 305-313
2022618 CIF
HKL
Paper
C56 H70 Ho4 N4 O33P 1 21/n 19.0957; 17.4571; 11.5422
90; 95.107; 90
1825.45Zhou, Juan; Zhang, Xinlei; Zi, Wenwen; Zhou, Lian
Two-dimensional rare-earth-metal coordination polymers based on biphenyl-3,3',5,5'-tetracarboxylic acid displaying luminescence
Acta Crystallographica Section C, 2022, 78
2022619 CIF
HKL
Paper
C64 H82 Eu4 N6 O32P 1 21/n 19.3197; 17.6285; 11.2707
90; 94.131; 90
1846.88Zhou, Juan; Zhang, Xinlei; Zi, Wenwen; Zhou, Lian
Two-dimensional rare-earth-metal coordination polymers based on biphenyl-3,3',5,5'-tetracarboxylic acid displaying luminescence
Acta Crystallographica Section C, 2022, 78
2022620 CIF
HKL
Paper
C17 H20 N4 O5P 21 21 217.2057; 11.0792; 41.2346
90; 90; 90
3291.9Mei, Hui; Budow-Busse, Simone; Kondhare, Dasharath; Eickmeier, Henning; Reuter, Hans; Seela, Frank
The 2'-deoxyribofuranoside of 3-phenyltetrahydropyrimido[4,5-<i>c</i>]pyridazin-7-one: a bicyclic nucleoside with sugar residues in <i>N</i> and <i>S</i> conformations, and its molecular recognition
Acta Crystallographica Section C, 2022, 78
2022621 CIF
HKL
Paper
C10 H9 N O S2P 1 c 14.9916; 10.8497; 10.0075
90; 98.411; 90
536.15Çakmak, Şükriye; Demircioğlu, Zeynep; Uzun, Serap; Veyisoğlu, Aysel; Yakan, Hasan; Ersanli, Cem Cüneyt
Synthesis, X-ray structure, antimicrobial activity, DFT and molecular docking studies of <i>N</i>-(thiophen-2-ylmethyl)thiophene-2-carboxamide
Acta Crystallographica Section C, 2022, 78
2022622 CIF
HKL
Paper
C29 H39 N5 O22C 1 c 19.4539; 29.9892; 13.1934
90; 106.454; 90
3587.3Nirmal Ram, Jeyaraman Selvaraj; Sathya, Udhayasuriyan; Gomathi, Sundaramoorthy; Cordes, David Bradford
Structure determination and Hirshfeld surface analysis of new cocrystal and salt forms of 5-aminotetrazole with hydroxy- and nitro-substituted carboxylic acids
Acta Crystallographica Section C, 2022, 78
2022623 CIF
HKL
Paper
C8 H7 N7 O7P 1 21/c 16.2591; 11.1312; 17.2257
90; 98.646; 90
1186.5Nirmal Ram, Jeyaraman Selvaraj; Sathya, Udhayasuriyan; Gomathi, Sundaramoorthy; Cordes, David Bradford
Structure determination and Hirshfeld surface analysis of new cocrystal and salt forms of 5-aminotetrazole with hydroxy- and nitro-substituted carboxylic acids
Acta Crystallographica Section C, 2022, 78
2022624 CIF
HKL
Paper
C14 H14 Cl N3 O4P c a 2123.7648; 8.5785; 6.9373
90; 90; 90
1414.28Kochel, Andrzej; Hołyńska, Małgorzata; Twaróg, Kamil; Jezierska, Aneta; Panek, Jarosław J.; Wojaczyński, Jacek
A new mixed-valence Cu^I^/Cu^II^ three-dimensional coordination polymer constructed with an <i>N</i>,<i>O</i>-donor ligand generated <i>via</i> solvothermal synthesis: structural features and magnetic properties
Acta Crystallographica Section C, 2022, 78
2022625 CIF
HKL
Paper
C28 H20 B2 Cu3 F8 N6 O6P b c n21.9637; 12.4106; 11.5844
90; 90; 90
3157.71Kochel, Andrzej; Hołyńska, Małgorzata; Twaróg, Kamil; Jezierska, Aneta; Panek, Jarosław J.; Wojaczyński, Jacek
A new mixed-valence Cu^I^/Cu^II^ three-dimensional coordination polymer constructed with an <i>N</i>,<i>O</i>-donor ligand generated <i>via</i> solvothermal synthesis: structural features and magnetic properties
Acta Crystallographica Section C, 2022, 78
2022626 CIF
HKL
Paper
C13 H9 I N2 O2P 1 21/n 19.4503; 12.7805; 10.9605
90; 100.687; 90
1300.84Bosch, Eric; Bowling, Nathan P.
Co-operative halogen bonds and nonconventional <i>sp</i>-C—H···O hydrogen bonds in 1:1 cocrystals formed between diethynylpyridines and <i>N</i>-halosuccinimides
Acta Crystallographica Section C, 2022, 78
2022627 CIF
HKL
Paper
C13 H9 I N2 O2P 1 21/n 110.4088; 5.32; 23.5462
90; 91.606; 90
1303.35Bosch, Eric; Bowling, Nathan P.
Co-operative halogen bonds and nonconventional <i>sp</i>-C—H···O hydrogen bonds in 1:1 cocrystals formed between diethynylpyridines and <i>N</i>-halosuccinimides
Acta Crystallographica Section C, 2022, 78
2022628 CIF
HKL
Paper
C13 H9 Br N2 O2P 1 21/n 110.2264; 5.3123; 23.281
90; 92.048; 90
1263.9Bosch, Eric; Bowling, Nathan P.
Co-operative halogen bonds and nonconventional <i>sp</i>-C—H···O hydrogen bonds in 1:1 cocrystals formed between diethynylpyridines and <i>N</i>-halosuccinimides
Acta Crystallographica Section C, 2022, 78
2022645 CIF
HKL
Paper
C12 H12 Fe N8P -17.7235; 9.4051; 10.5846
112.585; 102.828; 92.852
684.36Setifi, Zouaoui; Bernès, Sylvain; Geiger, David K.; Setifi, Fatima; Reedijk, Jan
Concomitant dimorphism in poly[di-μ-azido-(5,5'-dimethyl-2,2'-bipyridine)iron(II)]
Acta Crystallographica Section C, 2022, 78
2022646 CIF
HKL
Paper
C12 H12 Fe N8P 1 21/c 17.4901; 18.3242; 10.6219
90; 110.017; 90
1369.79Setifi, Zouaoui; Bernès, Sylvain; Geiger, David K.; Setifi, Fatima; Reedijk, Jan
Concomitant dimorphism in poly[di-μ-azido-(5,5'-dimethyl-2,2'-bipyridine)iron(II)]
Acta Crystallographica Section C, 2022, 78
2022647 CIF
HKL
Paper
C4 H8 Br N3 OP 1 21/n 18.7252; 7.7772; 10.7406
90; 97.969; 90
721.79Jeyaraman Selvaraj, Nirmalram; Sathya, Udhayasuriyan; Gomathi, Sundaramoorthy; Jegan Jennifer, Samson; Mathivathanan, Logesh; Abdul Razak, Ibrahim
Synthesis, crystal structure determination and Hirshfeld surface analysis of three new salt forms of creatinine with hydrobromic acid, 3-aminobenzoic acid and 3,5-dinitrobenzoic acid
Acta Crystallographica Section C, 2022, 78
2022648 CIF
HKL
Paper
C11 H14 N4 O3P 1 21 17.9887; 6.6098; 11.4753
90; 102.08; 90
592.52Jeyaraman Selvaraj, Nirmalram; Sathya, Udhayasuriyan; Gomathi, Sundaramoorthy; Jegan Jennifer, Samson; Mathivathanan, Logesh; Abdul Razak, Ibrahim
Synthesis, crystal structure determination and Hirshfeld surface analysis of three new salt forms of creatinine with hydrobromic acid, 3-aminobenzoic acid and 3,5-dinitrobenzoic acid
Acta Crystallographica Section C, 2022, 78
2022649 CIF
HKL
Paper
C11 H11 N5 O7P 1 21/c 15.4175; 22.634; 11.3668
90; 98.696; 90
1377.8Jeyaraman Selvaraj, Nirmalram; Sathya, Udhayasuriyan; Gomathi, Sundaramoorthy; Jegan Jennifer, Samson; Mathivathanan, Logesh; Abdul Razak, Ibrahim
Synthesis, crystal structure determination and Hirshfeld surface analysis of three new salt forms of creatinine with hydrobromic acid, 3-aminobenzoic acid and 3,5-dinitrobenzoic acid
Acta Crystallographica Section C, 2022, 78
2022650 CIF
HKL
Paper
C21 H15 Br N4 O2 SP -15.781; 12.717; 14.655
67.751; 78.78; 82.94
976.7Branowska, Danuta; Wysocki, Waldemar; Wolińska, Ewa; Koc, Karolina; Stańska, Katarzyna; Mirosław, Barbara; Karczmarzyk, Zbigniew
Synthesis, structure and sulfonamide–sulfonimide tautomerism of sulfonamide–1,2,4-triazine derivatives
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022651 CIF
HKL
Paper
C24 H20 N4 O4 SP 1 21/n 110.919; 8.0871; 24.875
90; 96.65; 90
2181.8Branowska, Danuta; Wysocki, Waldemar; Wolińska, Ewa; Koc, Karolina; Stańska, Katarzyna; Mirosław, Barbara; Karczmarzyk, Zbigniew
Synthesis, structure and sulfonamide–sulfonimide tautomerism of sulfonamide–1,2,4-triazine derivatives
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022652 CIF
HKL
Paper
Cd Ge2 Li4 S7C 1 c 116.8354; 6.787; 10.1499
90; 93.71; 90
1157.32Craig, Andrew J.; Shin, Seung Han; Cho, Jeong Bin; Balijapelly, Srikanth; Kelly, Jordan C.; Stoyko, Stanislav S.; Choudhury, Amitava; Jang, Joon I.; Aitken, Jennifer A.
Crystal structure, electronic structure, and optical properties of the novel Li~4~CdGe~2~S~7~, a wide-bandgap quaternary sulfide with a polar structure derived from lonsdaleite
Acta Crystallographica Section C, 2022, 78
2022653 CIF
HKL
Paper
C16 H17 N O4P 1 21/c 16.7134; 15.9685; 13.3879
90; 93.999; 90
1431.73Çakmak, Şükriye; Aycan, Tuğba; Öztürk, Filiz; Veyisoğlu, Aysel
Design, synthesis and spectroscopic and structural characterization of novel <i>N</i>-(2-hydroxy-5-methylphenyl)-2,3-dimethoxybenzamide: DFT, Hirshfeld surface analysis, antimicrobial activity, molecular docking and toxicology
Acta Crystallographica Section C, 2022, 78
2022654 CIF
HKL
Paper
C19 H15 Cd N2 O4P 1 21/n 112.5769; 7.5529; 18.5933
90; 99.863; 90
1740.11Shen, Hong
A new two-dimensional cadmium(II) coordination polymer based on the asymmetric dicarboxylic acid homophthalic acid: synthesis, structure and properties
Acta Crystallographica Section C, 2022, 78
2022655 CIF
HKL
Paper
C14 H32 Cl6 Fe2 N4C 1 2/c 120.3512; 6.4815; 18.049
90; 100.452; 90
2341.3DeLancey, Stephanie S.; Clendening, Reese A.; Zeller, Matthias; Ren, Tong
Geometric isomers of dichloridoiron(III) complexes of CTMC (5,7,12,14-tetramethyl-1,4,8,11-tetraazacyclotetradecane)
Acta Crystallographica Section C, 2022, 78, 507-514
2022656 CIF
HKL
Paper
C15 H36 Cl3 Fe N4 OP 1 21/c 18.1632; 20.847; 12.1387
90; 95.024; 90
2057.8DeLancey, Stephanie S.; Clendening, Reese A.; Zeller, Matthias; Ren, Tong
Geometric isomers of dichloridoiron(III) complexes of CTMC (5,7,12,14-tetramethyl-1,4,8,11-tetraazacyclotetradecane)
Acta Crystallographica Section C, 2022, 78, 507-514
2022657 CIF
HKL
Paper
C14 H32 Cl3 Fe N4P b c n9.2912; 11.9579; 17.267
90; 90; 90
1918.4DeLancey, Stephanie S.; Clendening, Reese A.; Zeller, Matthias; Ren, Tong
Geometric isomers of dichloridoiron(III) complexes of CTMC (5,7,12,14-tetramethyl-1,4,8,11-tetraazacyclotetradecane)
Acta Crystallographica Section C, 2022, 78, 507-514
2022661 CIF
HKL
Paper
C15 H23 N3 O3 SP 1 21/n 16.1202; 25.213; 10.5669
90; 106.403; 90
1564.2Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022662 CIF
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Paper
C14 H21 N3 O4 SP -18.504; 12.229; 15.834
102.194; 91.589; 95.875
1599Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022663 CIF
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Paper
C14 H23 N3 O5 SP 1 21/c 18.2022; 6.3857; 34.166
90; 110.022; 90
1681.35Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022664 CIF
HKL
Paper
C14 H21 N3 O3 S2P -16.2286; 8.5209; 16.2157
84.881; 79.671; 84.66
840.68Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022665 CIF
HKL
Paper
C20 H26 N4 O3 SP -18.4423; 12.0126; 20.3063
100.315; 96.533; 95.678
1997.85Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022666 CIF
HKL
Paper
C17 H18 N4 O3 SP 1 21/c 111.0524; 19.127; 8.8414
90; 107.131; 90
1786.1Kayukova, Lyudmila A.; Vologzhanina, Anna V.; Yergaliyeva, Elmira M.; Baitursynova, Gulnur P.; Shulgau, Zarina T.; Sergazy, Shynggys
Crystal structure and antidiabetic activity of 2-aminospiropyrazolinium tosylates and the product of <i>O</i>-tosylation of β-(benzimidazol-1-yl)propioamidoxime
Acta Crystallographica Section C, 2022, 78
2022667 CIF
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Paper
C18 H14 F NP 1 21/c 113.5921; 12.7103; 7.6215
90; 103.133; 90
1282.25Vera, Diana Rocío; Mantilla, Juan P.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of three new 2-methyl-4-styrylquinolines formed using Friedländer reactions between (2-aminophenyl)chalcones and acetone
Acta Crystallographica Section C, 2022, 78
2022668 CIF
HKL
Paper
C19 H14 F3 NC 1 2/c 117.2696; 10.8096; 16.1495
90; 91.44; 90
3013.8Vera, Diana Rocío; Mantilla, Juan P.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of three new 2-methyl-4-styrylquinolines formed using Friedländer reactions between (2-aminophenyl)chalcones and acetone
Acta Crystallographica Section C, 2022, 78
2022669 CIF
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Paper
C18 H13 Cl2 NC 1 2/c 130.5651; 3.8629; 25.5357
90; 110.497; 90
2824.1Vera, Diana Rocío; Mantilla, Juan P.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Synthesis and spectroscopic and structural characterization of three new 2-methyl-4-styrylquinolines formed using Friedländer reactions between (2-aminophenyl)chalcones and acetone
Acta Crystallographica Section C, 2022, 78
2022670 CIF
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Paper
C10 H18 O5 SP 21 21 216.72815; 11.24661; 15.51195
90; 90; 90
1173.77Cheng, Hong; Yan, Dingce; Wu, Liqing; Liang, Ping; Cai, Yuncheng; Li, Li
Chemical characterization, absolute configuration and optical purity of (1<i>S</i>)-(+)- and (1<i>R</i>)-(–)-10-camphorsulfonic acid
Acta Crystallographica Section C, 2022, 78
2022671 CIF
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Paper
C10 H18 O5 SP 21 21 216.72595; 11.23408; 15.51954
90; 90; 90
1172.65Cheng, Hong; Yan, Dingce; Wu, Liqing; Liang, Ping; Cai, Yuncheng; Li, Li
Chemical characterization, absolute configuration and optical purity of (1<i>S</i>)-(+)- and (1<i>R</i>)-(–)-10-camphorsulfonic acid
Acta Crystallographica Section C, 2022, 78
2022672 CIF
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Paper
C17 H18 N4 O3P -16.8722; 11.0502; 11.209
65.618; 89.798; 87.085
774.14Wójcicka, Anna; Becan, Lilianna; Rembiałkowska, Nina; Pyra, Anna; Bryndal, Iwona
Structure and cytotoxic properties of 1-hydroxy-5-methyl-7-phenylpyrido[3,4-<i>d</i>]pyridazin-4(3<i>H</i>)-one and its mono- and disubstituted ethyl acetates
Acta Crystallographica Section C, 2022, 78, 559-569
2022673 CIF
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Paper
C18 H17 N3 O4P 1 21/c 117.4344; 13.08; 7.0192
90; 92.315; 90
1599.37Wójcicka, Anna; Becan, Lilianna; Rembiałkowska, Nina; Pyra, Anna; Bryndal, Iwona
Structure and cytotoxic properties of 1-hydroxy-5-methyl-7-phenylpyrido[3,4-<i>d</i>]pyridazin-4(3<i>H</i>)-one and its mono- and disubstituted ethyl acetates
Acta Crystallographica Section C, 2022, 78, 559-569
2022674 CIF
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Paper
C22 H23 N3 O6P -18.679; 8.751; 15.137
92.24; 106.06; 109.46
1030.7Wójcicka, Anna; Becan, Lilianna; Rembiałkowska, Nina; Pyra, Anna; Bryndal, Iwona
Structure and cytotoxic properties of 1-hydroxy-5-methyl-7-phenylpyrido[3,4-<i>d</i>]pyridazin-4(3<i>H</i>)-one and its mono- and disubstituted ethyl acetates
Acta Crystallographica Section C, 2022, 78, 559-569
2022675 CIF
HKL
Paper
C6 H3 I2 N O2P 1 21/m 14.181; 15.0336; 6.797
90; 96.506; 90
424.48Bosch, Eric; Bowling, Nathan P.; Speetzen, Erin D.
A structural and computational comparison of close contacts and related intermolecular energies of interaction in the structures of 1,3-diiodo-5-nitrobenzene, 1,3-dibromo-5-nitrobenzene, and 1,3-dichloro-5-nitrobenzene
Acta Crystallographica Section C, 2022, 78, 552-558
2022676 CIF
HKL
Paper
C6 H3 Br2 N O2P 1 21/m 13.9721; 14.164; 6.7971
90; 96.486; 90
379.96Bosch, Eric; Bowling, Nathan P.; Speetzen, Erin D.
A structural and computational comparison of close contacts and related intermolecular energies of interaction in the structures of 1,3-diiodo-5-nitrobenzene, 1,3-dibromo-5-nitrobenzene, and 1,3-dichloro-5-nitrobenzene
Acta Crystallographica Section C, 2022, 78, 552-558
2022677 CIF
HKL
Paper
C6 H3 Cl2 N O2P 1 21/m 13.8115; 13.6452; 6.8976
90; 94.632; 90
357.56Bosch, Eric; Bowling, Nathan P.; Speetzen, Erin D.
A structural and computational comparison of close contacts and related intermolecular energies of interaction in the structures of 1,3-diiodo-5-nitrobenzene, 1,3-dibromo-5-nitrobenzene, and 1,3-dichloro-5-nitrobenzene
Acta Crystallographica Section C, 2022, 78, 552-558
2022679 CIF
HKL
Paper
Ir2 S3P b c n8.4728; 6.01563; 6.1537
90; 90; 90
313.649Yoshiasa, Akira; Kitahara, Ginga; Tokuda, Makoto; Ishimaru, Satoko; Ono, Shin-ichiro; Terai, Kunihisa; Nakatsuka, Akihiko; Sugiyama, Kazumasa
Single-crystal structure refinements and Debye temperatures of Ir2S3 kashinite and Rh2S3 bowieite
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022680 CIF
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Paper
Rh2 S3P b c n8.4672; 5.98537; 6.13921
90; 90; 90
311.131Yoshiasa, Akira; Kitahara, Ginga; Tokuda, Makoto; Ishimaru, Satoko; Ono, Shin-ichiro; Terai, Kunihisa; Nakatsuka, Akihiko; Sugiyama, Kazumasa
Single-crystal structure refinements and Debye temperatures of Ir2S3 kashinite and Rh2S3 bowieite
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022681 CIF
HKL
Paper
C16 H12 O7P 1 21/c 17.4465; 8.0745; 23.16
90; 94.31; 90
1388.6An, Yan-Yan; Su, Li-Jun; Zhao, Xin; Yan, Juan-Zhi
Cd^II^-based compound as a multi-responsive fluorescent probe for sensing Fe^III^ cations and Cr^VI^ oxyanions
Acta Crystallographica Section C, 2022, 78
2022682 CIF
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Paper
C28 H20 Cd N4 O7P 1 21/n 110.1105; 12.0603; 21.2013
90; 103.067; 90
2518.3An, Yan-Yan; Su, Li-Jun; Zhao, Xin; Yan, Juan-Zhi
Cd^II^-based compound as a multi-responsive fluorescent probe for sensing Fe^III^ cations and Cr^VI^ oxyanions
Acta Crystallographica Section C, 2022, 78
2022683 CIF
HKL
Paper
C18 H26 O6P 19.4726; 10.3; 15.3583
73.378; 88.382; 86.4
1432.94Mohammed, Adnan I.; Bhadbhade, Mohan M.; Read, Roger W.
3,4-Bis-<i>O</i>-propargyl-1,2:5,6-di-<i>O</i>-isopropylidene-<small>D</small>-mannitol: a study of multiple weak hydrogen bonds in the solid state
Acta Crystallographica Section C, 2022, 78
2022684 CIF
HKL
Paper
C10 H4.04 Br5.96 FeP -17.0903; 7.4318; 13.8071
88.745; 84.993; 77.728
708.21Blockhaus, Tobias; Sünkel, Karlheinz
Isolation and crystal and molecular structures of [(C5H2Br3)2Fe], [(C5HBr4)2Fe] and [(C5Br5)(C5Br4HgBr)Fe]
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022685 CIF
HKL
Paper
C10 H2 Br8 FeP -16.9395; 7.0548; 8.9271
67.577; 76.16; 86.461
392.06Blockhaus, Tobias; Sünkel, Karlheinz
Isolation and crystal and molecular structures of [(C5H2Br3)2Fe], [(C5HBr4)2Fe] and [(C5Br5)(C5Br4HgBr)Fe]
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022686 CIF
HKL
Paper
C10 Br10 Fe HgP 1 21/n 18.9784; 14.0971; 15.8485
90; 90.689; 90
2005.79Blockhaus, Tobias; Sünkel, Karlheinz
Isolation and crystal and molecular structures of [(C5H2Br3)2Fe], [(C5HBr4)2Fe] and [(C5Br5)(C5Br4HgBr)Fe]
Acta Crystallographica Section C Structural Chemistry, 2022, 78
2022687 CIF
HKL
Paper
C22 H31 NP -19.623; 10.13; 10.151
104.686; 103.935; 98.024
907.6Gupta, Sakuntala; Das, Partha Pratim; Crispini, Alessandra; Scarpelli, Francesca; Borbone, Fabio; Centore, Roberto
Crystal and mesophase structure of a bicyclohexyl cyano mesogen
Acta Crystallographica Section C, 2022, 78
2022688 CIF
HKL
Paper
C48 H42 Cl6 Cu F6 N2 O P3P 1 21/c 115.0438; 13.42; 25.3937
90; 100.933; 90
5033.6Kong, Yu-Jie; Wang, Jian-Teng; Song, Li
A new heteroleptic cuprous polymer constructed by a cyanopyridine ligand exhibiting a supramolecular framework structure and luminescence
Acta Crystallographica Section C, 2022, 78
2022689 CIF
HKL
Paper
C8 H11 B F4 OP n m a9.7906; 9.6859; 9.8673
90; 90; 90
935.72Mandal, Koushik; Sarkar, Sounak; Ghosh, Peuli; Hathwar, Venkatesha R.; Chopra, Deepak
Quantitative insights into noncovalent interactions involving halogen and tetrel bonds in 2,4,6-trimethylpyrylium tetrafluoroborate
Acta Crystallographica Section C, 2022, 78
2022690 CIF
HKL
Paper
C24 H21 B Br PP -19.492; 10.0234; 12.0606
81.515; 74.038; 67.798
1020.21Allen, Caleb J.; Olden, Alex M.; Yates, James L.; Wheeler, Kraig A.; Abbey, Eric R.
Synthesis, crystal structure and Hirshfeld analysis of triphenylphosphine–(4-bromophenyl)borane
Acta Crystallographica Section C, 2022, 78
2022693 CIF
HKL
Paper
C19 H24 F N3 O5P 21 21 217.1687; 10.6689; 23.4887
90; 90; 90
1796.47Felczak, Aleksandra; Kalinowska-Lis, Urszula; Kusz, Joachim; Checińska, Lilianna
Zwitterionic <i>versus</i> neutral molecules of fluoroquinolones: crystal structure of danofloxacin dihydrate
Acta Crystallographica Section C, 2022, 78
2022694 CIF
HKL
Paper
C19 H24 F N3 O5P 21 21 217.1815; 10.684; 23.5104
90; 90; 90
1803.89Felczak, Aleksandra; Kalinowska-Lis, Urszula; Kusz, Joachim; Checińska, Lilianna
Zwitterionic <i>versus</i> neutral molecules of fluoroquinolones: crystal structure of danofloxacin dihydrate
Acta Crystallographica Section C, 2022, 78
2022695 CIF
Paper
C8 H4 I2 N2 SP b c a11.0392; 8.1756; 23.3673
90; 90; 90
2108.95De Silva, Viraj; Magueres, Pierre Le; Averkiev, Boris B.; Aakeröy, Christer B.
Competition between chalcogen and halogen bonding assessed through isostructural species
Acta Crystallographica Section C, 2022, 78
2022696 CIF
HKL
Paper
C8 H4 Br2 N2 SeP b c a11.1945; 7.1006; 25.4725
90; 90; 90
2024.75De Silva, Viraj; Magueres, Pierre Le; Averkiev, Boris B.; Aakeröy, Christer B.
Competition between chalcogen and halogen bonding assessed through isostructural species
Acta Crystallographica Section C, 2022, 78
2022697 CIF
HKL
Paper
C8 H4 Br I N2 SeP b c a11.1735; 7.1222; 26.1875
90; 90; 90
2084De Silva, Viraj; Magueres, Pierre Le; Averkiev, Boris B.; Aakeröy, Christer B.
Competition between chalcogen and halogen bonding assessed through isostructural species
Acta Crystallographica Section C, 2022, 78
2022698 CIF
HKL
Paper
C8 H4 Br I N2 SP b c a10.9919; 6.9945; 26.4076
90; 90; 90
2030.29De Silva, Viraj; Magueres, Pierre Le; Averkiev, Boris B.; Aakeröy, Christer B.
Competition between chalcogen and halogen bonding assessed through isostructural species
Acta Crystallographica Section C, 2022, 78
2022700 CIF
HKL
Paper
C8 H17 Cl N6 OC 1 2/c 119.294; 9.4173; 13.743
90; 108.57; 90
2367.1Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F.
Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 133-141
2022701 CIF
HKL
Paper
C4 H7 N3P -15.9577; 6.7494; 6.8249
101.641; 104.225; 111.425
234.36Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F.
Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 133-141
2022702 CIF
HKL
Paper
C4 H6 N2 OP 1 21/n 17.3685; 8.0074; 8.4211
90; 115.741; 90
447.56Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F.
Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 133-141
2022703 CIF
HKL
Paper
C5 H8 N2 OP -16.3296; 7.0222; 7.351
84.975; 71.693; 63.889
278.05Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F.
Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 133-141
2022704 CIF
HKL
Paper
C6 H13 N3 OP 1 21/c 19.4887; 14.5341; 12.2828
90; 111.32; 90
1578Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F.
Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 133-141
2022705 CIF
HKL
Paper
C4 H2 Cl N O2 SP 1 21 19.7839; 10.2313; 18.272
90; 97.125; 90
1814.9George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J.
Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 125-132
2022706 CIF
HKL
Paper
C3 H4 Br2 Cl N OP 1 21 16.5967; 24.1942; 9.1724
90; 91.904; 90
1463.12George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J.
Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 125-132
2022707 CIF
HKL
Paper
C10 H7 Br2 N O2 SP c a 217.1195; 16.4402; 9.7821
90; 90; 90
1144.96George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J.
Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 125-132
2022708 CIF
HKL
Paper
Ga18 Mg Mn4P 4/m m m6.3116; 6.3116; 9.944
90; 90; 90
396.13Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Chumak, Ihor; Indris, Sylvio; Schwarz, Bjoern; Ehrenberg, Helmut
MgMn~4~Ga~18~: a novel three-shell gallium cluster structure
Acta Crystallographica, Section C, 2022, 78, 455-461
2022776 CIF
HKL
Paper
C18 H14 N2 OP c a 219.1548; 9.7791; 15.6336
90; 90; 90
1399.61Ghichi, Nadir; Djedouani, Amel; Hannachid, Douniazed; Elhadi, Said Mohamed; Benboudiaf, Ali; Merazig, Hocine; Ouksel, Louiza; Hellal, Abdelkader; Stoeckli-Evans, Helen
Synthesis and crystal structures of two 1H-benzo[d]imidazole derivatives: DFT and anticorrosion studies, and Hirshfeld surface analysis
Acta Crystallographica Section C Structural Chemistry, 2023, 79, 292-304
2022777 CIF
HKL
Paper
C32 H30 N2 O3P -110.7065; 10.9434; 12.8256
69.029; 82.871; 67.515
1296.37Ghichi, Nadir; Djedouani, Amel; Hannachid, Douniazed; Elhadi, Said Mohamed; Benboudiaf, Ali; Merazig, Hocine; Ouksel, Louiza; Hellal, Abdelkader; Stoeckli-Evans, Helen
Synthesis and crystal structures of two 1H-benzo[d]imidazole derivatives: DFT and anticorrosion studies, and Hirshfeld surface analysis
Acta Crystallographica Section C Structural Chemistry, 2023, 79, 292-304
2022834 CIF
HKL
Paper
C8 H7 N3 O2P 1 21/c 17.6327; 9.5561; 11.2899
90; 104.095; 90
798.68Decato, Daniel; Jahnke, Michael; Berryman, Orion
Conformational polymorphism of 3-(azidomethyl)benzoic acid
Acta Crystallographica Section C Structural Chemistry, 2023, 79
2022835 CIF
Paper
C8 H7 N3 O2P 1 21/n 13.7712; 6.1229; 34.868
90; 93.099; 90
803.95Decato, Daniel; Jahnke, Michael; Berryman, Orion
Conformational polymorphism of 3-(azidomethyl)benzoic acid
Acta Crystallographica Section C Structural Chemistry, 2023, 79
2022836 CIF
HKL
Paper
C8 H7 N3 O2P -13.8029; 9.9199; 11.5709
66.828; 82.168; 82.245
395.96Decato, Daniel; Jahnke, Michael; Berryman, Orion
Conformational polymorphism of 3-(azidomethyl)benzoic acid
Acta Crystallographica Section C Structural Chemistry, 2023, 79
2022847 CIF
HKL
Paper
C40 H40 Cl2 F6 N P2 Pt S SbP 21 21 2112.9774; 18.3039; 18.2877
90; 90; 90
4344Faller, Jack; Parr, Jonathan
Hemilability and structural considerations in complexes of platinum(II) comprising bis(diphenylphosphanyl)methane monoxide, monosulfide, and monoselenide
Acta Crystallographica Section C Structural Chemistry, 2023, 79
2022996 CIF
HKL
Paper
Ba2 Mn1.71 Te5 Y0.87C 1 2/m 115.1466; 4.5782; 10.606
90; 116.956; 90
655.56Yadav, Sweta; Prakash, Jai
Synthesis and crystal structure of Ba2Y0.87(1)Mn1.71(1)Te5
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2022997 CIF
HKL
Paper
C15 H17 Br N2 SP 21 21 217.9846; 9.1982; 19.3636
90; 90; 90
1422.14Savin, J. Alejandro; Ávila-Ortíz, C. Gabriela; Leyva-Ramírez, Marco Antonio; Juaristi, Eusebio
X-ray crystallographic structure of a novel enantiopure chiral isothiourea with potential applications in enantioselective synthesis
Acta Crystallographica Section C Structural Chemistry, 2024, 80, 15-20
2023017 CIF
Paper
C66 H44 Cu3 Eu2 N18 O31R -3 c :H14.0021; 14.0021; 63.523
90; 90; 120
10785.7Yang, Ke; Yang, Yuting; Yao, Ziqin; Cheng, Sisi; Cui, Xue; Wang, Xingyi; Han, Yi; Yi, Feiyan; Mo, Guang
High-pressure study of a 3d–4f heterometallic CuEu–organic skeleton
Acta Crystallographica Section C Structural Chemistry, 2024, 80, 49-55
2023076 CIF
Paper
C18 H19 Br N2 O3 SP b c a12.407; 17.425; 17.5276
90; 90; 90
3789.3Kolade, Sherif O.; Aina, Oluwafemi S.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
Synthesis, crystal structure and in-silico evaluation of arylsulfonamide Schiff bases for potential activity against colon cancer.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 129-142
2023209 CIF
HKL
Paper
C17 H18 N6P 1 21 18.711; 19.5857; 18.9372
90; 90.857; 90
3230.53Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2023210 CIF
HKL
Paper
C17 H22 N6 O2P 21 21 219.9563; 15.1596; 23.6491
90; 90; 90
3569.4Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2023211 CIF
HKL
Paper
C17 H21 N6 O4 PP 21 21 217.1398; 12.0894; 43.818
90; 90; 90
3782.2Peng, Ziyu; Ye, Long
Comparison of the crystal structures of the JAK1/2 inhibitor ruxolitinib and its hydrate and phosphate
Acta Crystallographica Section C Structural Chemistry, 2024, 80
2311092 CIF
HKL
Paper
C7 H5 F O3P 1 21/c 123.1729; 3.6802; 15.6312
90; 109.728; 90
1254.8Lutz, Martin; Vliem, Jara F.; Rodenburg, Hendrik P.
Twinning in 5-fluorosalicylic acid: description of a new polymorph.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1-6
2311806 CIF
Paper
C12 H28 Cd Cl6 N16 O12P -19.4373; 9.5334; 10.4848
109.352; 110.768; 96.643
802.59Bouchene, Rafika; Bouacida, Sofiane; Berrah, Fadila; Roisnel, Thierry
A simple hydrated salt with a complex hydrogen-bonding network: tetrakis(5-amino-3-carboxy-4H-1,2,4-triazol-1-ium) hexachloridocadmate(II) tetrahydrate.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 672-676
2311807 CIFC8 H9 N O2P 21 21 213.9338; 14.022; 14.126
90; 90; 90
779.2Sparkes, Hazel A.; Sage, Henry J.; Yufit, Dmitry S.
In-situ cryocrystallization of 1,2-dimethyl-3-nitrobenzene and 2,4-dimethyl-1-nitrobenzene.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 872-875
2311808 CIFC8 H9 N O2P 1 21/c 111.693; 9.738; 7.018
90; 106.54; 90
766Sparkes, Hazel A.; Sage, Henry J.; Yufit, Dmitry S.
In-situ cryocrystallization of 1,2-dimethyl-3-nitrobenzene and 2,4-dimethyl-1-nitrobenzene.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 872-875
2311809 CIF
Paper
Br2 Ca H18 O9P 1 21/n 17.8354; 8.7538; 18.2615
90; 101.041; 90
1229.36Hennings, Erik; Schmidt, Horst; Voigt, Wolfgang
Crystal structures of hydrates of simple inorganic salts. II. Water-rich calcium bromide and iodide hydrates: CaBr2 · 9H2O, CaI2 · 8H2O, CaI2 · 7H2O and CaI2 · 6.5H2O.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 876-881
2311810 CIF
Paper
Ca H16 I2 O8P -17.4521; 8.6127; 10.725
86.048; 84.184; 72.427
652.3Hennings, Erik; Schmidt, Horst; Voigt, Wolfgang
Crystal structures of hydrates of simple inorganic salts. II. Water-rich calcium bromide and iodide hydrates: CaBr2 · 9H2O, CaI2 · 8H2O, CaI2 · 7H2O and CaI2 · 6.5H2O.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 876-881
2311811 CIF
Paper
Ca2 H28 I4 O14P 1 21/c 19.841; 16.53; 14.639
90; 92.17; 90
2379.6Hennings, Erik; Schmidt, Horst; Voigt, Wolfgang
Crystal structures of hydrates of simple inorganic salts. II. Water-rich calcium bromide and iodide hydrates: CaBr2 · 9H2O, CaI2 · 8H2O, CaI2 · 7H2O and CaI2 · 6.5H2O.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 876-881
2311812 CIF
Paper
Ca H13 I2 O6.5C 1 2/c 116.466; 8.2919; 17.947
90; 111.045; 90
2286.9Hennings, Erik; Schmidt, Horst; Voigt, Wolfgang
Crystal structures of hydrates of simple inorganic salts. II. Water-rich calcium bromide and iodide hydrates: CaBr2 · 9H2O, CaI2 · 8H2O, CaI2 · 7H2O and CaI2 · 6.5H2O.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 876-881
2311813 CIF
Paper
C10 H12 N2 OP 1 21/c 17.695; 17.129; 7.8316
90; 115.525; 90
931.51Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311814 CIF
Paper
C15 H20 N2 OP 1 21/c 19.3086; 18.283; 8.1543
90; 103.328; 90
1350.4Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311815 CIF
Paper
C19 H16 N2 OP 1 21/n 15.5789; 7.6868; 33.128
90; 90.356; 90
1420.6Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311816 CIF
Paper
C20 H22 N2 OC 1 2/c 116.0939; 13.8666; 16.8556
90; 116.661; 90
3361.7Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311817 CIF
Paper
C20 H16 N2 OP 1 21/n 116.863; 10.1678; 18.694
90; 102.079; 90
3134.3Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311818 CIF
Paper
C20 H15 Cl N2 OP 1 21/n 119.432; 8.933; 19.496
90; 102.18; 90
3308.1Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311819 CIF
Paper
C15 H16 N2 O3P b c a13.382; 8.8183; 23.275
90; 90; 90
2746.6Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311820 CIF
Paper
C22 H20 N2 OP 1 21/n 111.1869; 7.9143; 20.233
90; 92.967; 90
1789Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
Structural similarities among eight benzoylhydrazones.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 912-919
2311821 CIF
Paper
C28 H22 Br2 S2P 1 21/c 18.3316; 16.1749; 18.1333
90; 96.677; 90
2427.12Nguyen, Hien; Nguyen Bich, Ngan; Dang, Tung T.; Van Meervelt, Luc
Stacking patterns of thieno[3,2-b]thiophenes functionalized by sequential palladium-catalyzed Suzuki and Heck cross-coupling reactions.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 895-899
2311822 CIF
Paper
C25 H16 Br2 S2P -14.1522; 13.2861; 19.6117
106.464; 94.945; 93.016
1030.32Nguyen, Hien; Nguyen Bich, Ngan; Dang, Tung T.; Van Meervelt, Luc
Stacking patterns of thieno[3,2-b]thiophenes functionalized by sequential palladium-catalyzed Suzuki and Heck cross-coupling reactions.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 895-899
2311823 CIF
Paper
C25 H22 Br2 S2P -19.5401; 10.1575; 12.1711
106.933; 98.599; 92.192
1111.4Nguyen, Hien; Nguyen Bich, Ngan; Dang, Tung T.; Van Meervelt, Luc
Stacking patterns of thieno[3,2-b]thiophenes functionalized by sequential palladium-catalyzed Suzuki and Heck cross-coupling reactions.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 895-899
2311824 CIF
Paper
C15 H14 Cl N OP -15.0039; 10.7525; 12.6177
108.615; 91.771; 90.167
643.01Nayak, Prakash S.; Jasinski, Jerry P.; Golen, James A.; Narayana, Badiadka; Kaur, Manpreet; Yathirajan, Hemmige S.; Glidewell, Christopher
Halogenated C,N-diarylacetamides: molecular conformations and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 889-894
2311825 CIF
Paper
C15 H14 Br N OP -14.9995; 10.8392; 12.7301
108.149; 91.968; 90.31
655.05Nayak, Prakash S.; Jasinski, Jerry P.; Golen, James A.; Narayana, Badiadka; Kaur, Manpreet; Yathirajan, Hemmige S.; Glidewell, Christopher
Halogenated C,N-diarylacetamides: molecular conformations and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 889-894
2311826 CIF
Paper
C15 H12 Cl3 N OP 1 21 111.8441; 4.7288; 13.0981
90; 101.31; 90
719.36Nayak, Prakash S.; Jasinski, Jerry P.; Golen, James A.; Narayana, Badiadka; Kaur, Manpreet; Yathirajan, Hemmige S.; Glidewell, Christopher
Halogenated C,N-diarylacetamides: molecular conformations and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 889-894
2311827 CIF
Paper
C15 H13 Br Cl N OP 1 21/c 111.8458; 4.7282; 25.0757
90; 98.133; 90
1390.35Nayak, Prakash S.; Jasinski, Jerry P.; Golen, James A.; Narayana, Badiadka; Kaur, Manpreet; Yathirajan, Hemmige S.; Glidewell, Christopher
Halogenated C,N-diarylacetamides: molecular conformations and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 889-894
2311828 CIF
Paper
C10 H13 Cl N4 O3 SP -15.4118; 11.5632; 11.743
109.462; 94.399; 102.509
667.51Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311829 CIF
Paper
C10.5 H13 Cl N4 O2.5 SP -15.6468; 11.2749; 11.8363
64.254; 79.361; 77.687
659.53Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311830 CIF
Paper
C10 H13 Br N4 O3 SP 1 21/n 111.942; 5.6295; 21.0659
90; 98.38; 90
1401.09Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311831 CIF
Paper
C20 H22 I4 N8 O4 S2P -15.7792; 12.0002; 12.5214
61.964; 87.745; 76.426
742.51Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311832 CIF
Paper
C10 H13 B F4 N4 O3 SP 1 21/n 15.8539; 11.3629; 21.208
90; 90.982; 90
1410.49Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311833 CIF
Paper
C10 H11 N5 O5 SP -15.4705; 10.1235; 11.9956
86.708; 85.489; 74.394
637.4Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311834 CIF
Paper
C12 H16 N4 O5 S2P 1 21/c 15.5269; 34.979; 8.4395
90; 93.102; 90
1629.2Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311835 CIF
Paper
C16 H20 N4 O8 S2P 1 21/n 118.5872; 5.9733; 18.685
90; 104.858; 90
2005.17Buist, Amanda R.; Dennany, Lynn; Kennedy, Alan R.; Manzie, Craig; McPhie, Katherine; Walker, Brandon
Eight salt forms of sulfadiazine.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 900-907
2311836 CIF
Paper
C10 H6 Cl N3 SP -17.5805; 9.7942; 13.6175
97.712; 96.549; 99.416
978.77Praveen, Aletti S.; Yathirajan, Hemmige S.; Kaur, Manpreet; Narayana, Badiadka; Hosten, Eric C.; Betz, Richard; Glidewell, Christopher
Different patterns of supramolecular assembly in constitutionally similar 6-arylimidazo[2,1-b][1,3,4]thiadiazoles.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 920-926
2311837 CIF
Paper
C11 H8 Cl N3 SP b c a7.5567; 11.4589; 24.9006
90; 90; 90
2156.18Praveen, Aletti S.; Yathirajan, Hemmige S.; Kaur, Manpreet; Narayana, Badiadka; Hosten, Eric C.; Betz, Richard; Glidewell, Christopher
Different patterns of supramolecular assembly in constitutionally similar 6-arylimidazo[2,1-b][1,3,4]thiadiazoles.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 920-926
2311838 CIF
Paper
C10 H5 Cl2 N3 SP -15.5186; 7.5194; 12.8406
102.027; 91.293; 98.43
514.74Praveen, Aletti S.; Yathirajan, Hemmige S.; Kaur, Manpreet; Narayana, Badiadka; Hosten, Eric C.; Betz, Richard; Glidewell, Christopher
Different patterns of supramolecular assembly in constitutionally similar 6-arylimidazo[2,1-b][1,3,4]thiadiazoles.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 920-926
2311839 CIF
Paper
C12 H10 F N3 O SP -18.6766; 11.7888; 12.5227
103.039; 95.189; 110.365
1149.69Praveen, Aletti S.; Yathirajan, Hemmige S.; Kaur, Manpreet; Narayana, Badiadka; Hosten, Eric C.; Betz, Richard; Glidewell, Christopher
Different patterns of supramolecular assembly in constitutionally similar 6-arylimidazo[2,1-b][1,3,4]thiadiazoles.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 920-926
2311840 CIF
Paper
C15 H12 N4 O S2P -17.4999; 8.8965; 11.2806
83.338; 73.354; 86.406
715.92Insuasty, Henry; Insuasty, Braulio; Castro, Edison; Cobo, Justo; Glidewell, Christopher
2-Ethylsulfanyl-7-(furan-2-yl)-4-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazine: π-stacked chains of hydrogen-bonded R2(2)(10) dimers.
Acta crystallographica. Section C, Structural chemistry, 2014, 70, 908-911
2311841 CIFC14 H26 Br N O2P 1 21/c 18.847; 17.679; 9.564
90; 100.38; 90
1471.4Rojek, Tomasz; Lis, Tadeusz; Matczak-Jon, Ewa
Dicyclohexylammonium bromoacetate: a low molecular mass organogelator with a one-dimensional secondary ammonium monocarboxylate (SAM) synthon.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 593-597
2311842 CIF
Paper
C38 H50 Cu2 F12 N10 P2P 1 21 18.9698; 12.4288; 20.3978
90; 90.7276; 90
2273.84Riener, Korbinian; Pöthig, Alexander; Cokoja, Mirza; Herrmann, Wolfgang A.; Kühn, Fritz E
Structure and spectroscopic properties of the dimeric copper(I) N-heterocyclic carbene complex [Cu₂(CNC(t-Bu))₂](PF₆)₂.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 643-646
2311843 CIF
Paper
C17 H23 N O4P b c a15.0721; 11.3109; 19.4443
90; 90; 90
3314.85Mierina, Inese; Mishnev, Anatoly; Jure, Mara
Zwitterionic and free forms of arylmethyl Meldrum's acids.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 752-758
2311844 CIF
Paper
C16 H20 O7P b c a9.8128; 10.0235; 30.4669
90; 90; 90
2996.68Mierina, Inese; Mishnev, Anatoly; Jure, Mara
Zwitterionic and free forms of arylmethyl Meldrum's acids.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 752-758
2311845 CIF
Paper
C15 H18 O7C 1 2/c 122.9942; 10.184; 26.9904
90; 112.125; 90
5855Mierina, Inese; Mishnev, Anatoly; Jure, Mara
Zwitterionic and free forms of arylmethyl Meldrum's acids.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 752-758
2311846 CIF
Paper
C20 H12 Cl4 N2 O5 ZnP 1 21/c 119.154; 7.939; 13.936
90; 93.613; 90
2114.9Homzová, Katarína; Györyová, Katarína; Koman, Marián; Melník, Milan; Juhászová, Žofia
Synthesis, crystal structure, and spectroscopic and thermal properties of the polymeric compound catena-poly[[bis(2,4-dichlorobenzoato)zinc(II)]-μ-isonicotinamide].
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 814-819
2311847 CIF
Paper
C36 H28 F4 I2 N6 Ni S2I 41/a :216.2034; 16.2034; 28.698
90; 90; 90
7534.7Şerb, Mihaela-Diana; Merkens, Carina; Kalf, Irmgard; Englert, Ulli
Halogen bonds on demand: I···S contacts in cocrystals of trans-bis(thiocyanato-κN)tetrakis(4-vinylpyridine-κN)nickel(II) and 2,3,5,6-tetrafluoro-1,4-diiodobenzene.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 991-995
2311848 CIF
Paper
C11 H7 N5 O4 S ZnP -4 21 c16.7143; 16.7143; 9.4518
90; 90; 90
2640.53Liu, Yang; Feng, Yong Lan; Fu, Wei Wei
A new two-dimensional extended adenine and thiophenecarboxylate mixed-ligand zinc(II) complex: synthesis, structure, thermostability and luminescent properties.
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 1069-1073
2311849 CIF
Paper
C36 H35 F12 Fe N12 P3P -110.1146; 12.1591; 17.7002
97.219; 97.02; 102.06
2087.05Haslinger, Stefan; Pöthig, Alexander; Cokoja, Mirza; Kühn, Fritz E
Oxidative degradation of the organometallic iron(II) complex [Fe{bis[3-(pyridin-2-yl)-1H-imidazol-1-yl]methane}(MeCN)(PMe3)](PF6)2: structure of the ligand decomposition product trapped via coordination to iron(II).
Acta crystallographica. Section C, Structural chemistry, 2015, 71, 1096-1099
2311850 CIF
Paper
C17 H36 N3 O PP 1 21 111.9879; 19.1972; 17.072
90; 90.542; 90
3928.7Keikha, Mojtaba; Pourayoubi, Mehrdad; Tarahhomi, Atekeh; van der Lee, Arie
Syntheses and structures of four new mixed-amide phosphoric triamides.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 251-259
2311851 CIF
Paper
C20 H34 N3 O PP 1 21/c 110.9207; 24.0557; 24.3993
90; 98.98; 90
6331.3Keikha, Mojtaba; Pourayoubi, Mehrdad; Tarahhomi, Atekeh; van der Lee, Arie
Syntheses and structures of four new mixed-amide phosphoric triamides.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 251-259
2311852 CIF
Paper
C19 H38 N3 O P2P n a 2121.9179; 8.9546; 20.3544
90; 90; 90
3994.9Keikha, Mojtaba; Pourayoubi, Mehrdad; Tarahhomi, Atekeh; van der Lee, Arie
Syntheses and structures of four new mixed-amide phosphoric triamides.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 251-259
2311853 CIF
Paper
C12 H26 N3 O PP 21 21 216.3318; 10.3065; 23.1616
90; 90; 90
1511.5Keikha, Mojtaba; Pourayoubi, Mehrdad; Tarahhomi, Atekeh; van der Lee, Arie
Syntheses and structures of four new mixed-amide phosphoric triamides.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 251-259
2311854 CIFC11 H9 N O2P -15.0425; 9.0386; 10.1045
91.6608; 97.6593; 101.081
447.21Schirmer, Marie Luis; Spannenberg, Anke; Werner, Thomas
Highly functionalized alkenes produced from base-free organocatalytic Wittig reactions: (E)-3-benzylidenepyrrolidine-2,5-dione, (E)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (E)-3-benzylidene-1-tert-butylpyrrolidine-2,5-dione.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 504-508
2311855 CIFC12 H11 N O2P 1 21/n 17.5977; 18.2537; 8.0187
90; 116.727; 90
993.27Schirmer, Marie Luis; Spannenberg, Anke; Werner, Thomas
Highly functionalized alkenes produced from base-free organocatalytic Wittig reactions: (E)-3-benzylidenepyrrolidine-2,5-dione, (E)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (E)-3-benzylidene-1-tert-butylpyrrolidine-2,5-dione.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 504-508
2311856 CIFC15 H17 N O2P -110.2638; 12.1068; 12.2361
63.3851; 85.277; 71.4797
1285.74Schirmer, Marie Luis; Spannenberg, Anke; Werner, Thomas
Highly functionalized alkenes produced from base-free organocatalytic Wittig reactions: (E)-3-benzylidenepyrrolidine-2,5-dione, (E)-3-benzylidene-1-methylpyrrolidine-2,5-dione and (E)-3-benzylidene-1-tert-butylpyrrolidine-2,5-dione.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 504-508
2311857 CIF
Paper
C184 H224 B8 Br8 Cl16 F32 N16 Pd8P -115.7247; 18.8101; 19.1726
78.2025; 82.7526; 85.7404
5499.9Jandl, C.; Stegbauer, S.; Pöthig, A
A Pd4Br4 macrocycle trapped by cocrystallization from a highly dynamic equilibrium of η(3)-cycloheptatrienide complexes.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 509-513
2311858 CIF
Paper
C56 H108 F6 Mg N6 O33 S2P 316.4188; 16.4188; 8.8395
90; 90; 120
2063.67Fujita, Megumi; Kazerouni, Amaan M.; Bacsa, John
The structure of a valinomycin-hexaaquamagnesium trifluoromethanesulfonate compound.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 627-633
2311859 CIF
Paper
C17 H10 O S2A e a 218.2186; 20.0166; 7.2534
90; 90; 90
2645.13Katzsch, Felix; Gruber, Tobias; Weber, Edwin
Crystal structures of functional building blocks derived from bis(benzo[b]thiophen-2-yl)methane.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 679-684
2311860 CIF
Paper
C22 H20 O S2 SiP n m a19.3755; 17.0998; 5.9656
90; 90; 90
1976.51Katzsch, Felix; Gruber, Tobias; Weber, Edwin
Crystal structures of functional building blocks derived from bis(benzo[b]thiophen-2-yl)methane.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 679-684
2311861 CIF
Paper
C19 H12 O S2P 1 21/c 19.4426; 19.5197; 8.4323
90; 101.539; 90
1522.8Katzsch, Felix; Gruber, Tobias; Weber, Edwin
Crystal structures of functional building blocks derived from bis(benzo[b]thiophen-2-yl)methane.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 679-684
2311862 CIF
Paper
C12 H24 O8C 1 2/c 138.459; 8.6208; 8.242
90; 95.371; 90
2720.6Purushothaman, Gayathri; Juvale, Kapil; Kirubakaran, Sivapriya; Vemula, Praveen Kumar; Thiruvenkatam, Vijay
Water-mediated intermolecular interactions in 1,2-O-cyclohexylidene-myo-inositol: a quantitative analysis.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 20-27
2311863 CIF
Paper
C12 H34 As2 Mg N2 O16P 1 21/c 115.1693; 6.7367; 12.9532
90; 108.033; 90
1258.68Smith, Graham; Wermuth, Urs D.
The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67
2311864 CIF
Paper
C12 H22 As2 Ca N2 O10P -19.001; 9.672; 11.756
77.096; 74.096; 82.236
956.4Smith, Graham; Wermuth, Urs D.
The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67
2311865 CIF
Paper
C12 H20 As2 N2 O9 SrI 1 2/a 19.8935; 7.5844; 23.6669
90; 97.866; 90
1759.17Smith, Graham; Wermuth, Urs D.
The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67
2311866 CIF
Paper
C12 H20 As2 Ba N2 O9I 1 2/a 19.9997; 7.7305; 23.979
90; 98.214; 90
1834.6Smith, Graham; Wermuth, Urs D.
The coordination complex structures and hydrogen bonding in the three-dimensional alkaline earth metal salts (Mg, Ca, Sr and Ba) of (4-aminophenyl)arsonic acid.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 61-67
2311867 CIF
Paper
C5 H5 Cl Li NP 21 21 213.9329; 8.615; 17.836
90; 90; 90
604.3Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J.
Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269
2311868 CIFC28 H28 F6 Li N4 PA e a 224.725; 14.7026; 15.8325
90; 90; 90
5755.5Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J.
Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269
2311869 CIFC20 H20 F6 Li N4 PI -412.3857; 12.3857; 7.0065
90; 90; 90
1074.8Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J.
Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269
2311870 CIFC28 H28 Cl2 Li2 N4P 1 21/n 112.24; 18.88; 12.675
90; 105.864; 90
2817.5Jalil, AbdelAziz; Clymer, Rebecca N.; Hamilton, Clifton R.; Vaddypally, Shivaiah; Gau, Michael R.; Zdilla, Michael J.
Structure of salts of lithium chloride and lithium hexafluorophosphate as solvates with pyridine and vinylpyridine and structural comparisons: (C<sub>5</sub>H<sub>5</sub>N)LiPF<sub>6</sub>, [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]LiPF<sub>6</sub>, [(C<sub>5</sub>H<sub>5</sub>N)LiCl]<sub>n</sub>, and [p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>Li(μ-Cl)<sub>2</sub>Li[p-(CH<sub>2</sub>=CH)C<sub>5</sub>H<sub>4</sub>N]<sub>2</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 264-269
2311871 CIF
Paper
C30 H44 N2 O4P -19.2021; 10.2022; 16.532
74.49; 78.452; 76.849
1440.2Geiger, H. Cristina; Zick, Patricia L.; Roberts, William R.; Geiger, David K.
Synthesis and characterization of a novel long-alkyl-chain ester-substituted benzimidazole gelator and its octan-1-ol solvate.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 350-356
2311872 CIF
Paper
C5 H5 Cl N O3 P ZnC 1 2/c 115.26; 11.75; 10.334
90; 99.04; 90
1829.9Wilk-Kozubek, Magdalena; Jarzembska, Katarzyna N.; Janczak, Jan; Videnova-Adrabinska, Veneta
Synthesis, structural characterization and computational studies of catena-poly[chlorido[μ<sub>3</sub>-(pyridin-1-ium-3-yl)phosphonato-κ<sup>3</sup>O:O':O'']zinc(II)].
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 363-368
2311873 CIF
Paper
C28 H24 N8 O ZnC 1 2/c 128.73; 7.5129; 12.476
90; 111.97; 90
2497.3Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311874 CIF
Paper
C28 H24 N10 O6 ZnC 1 2/c 116.869; 12.488; 14.626
90; 114.98; 90
2792.9Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311875 CIF
Paper
C30 H30 N8 O2 ZnP 1 21/c 112.297; 12.663; 9.99
90; 111.58; 90
1446.6Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311876 CIF
Paper
C28 H24 Cd I2 N8C 1 2/c 118.848; 11.254; 15.707
90; 119.44; 90
2901.5Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311877 CIF
Paper
C28 H24 Cd N10 O6C 1 2/c 117.113; 12.603; 14.708
90; 115.8; 90
2855.9Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311878 CIF
Paper
C28 H24 Co N8 OC 1 2/c 128.735; 7.4617; 12.421
90; 111.79; 90
2472.9Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311879 CIF
Paper
C28 H26 N8 Ni O2I 1 2/a 126.778; 7.4858; 12.472
90; 92.91; 90
2496.8Liu, Feng Yi; Zhou, Dong Mei; Zhao, Xiao Lan; Kou, Jun Feng
Synthesis, crystal structures and luminescence properties of seven mononuclear zinc(II), cadmium(II), cobalt(II) and nickel(II) complexes with 5-(4-methylphenyl)-3-(pyridin-2-yl)-1H-1,2,4-triazole.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 382-392
2311880 CIF
Paper
C31 H28 Fe I PP -110.6203; 11.8441; 12.3126
99.255; 100.973; 111.584
1367.9Bouchene, Rafika; Daran, Jean Claude; Merazig, Hocine; Manoury, Eric; Bouacida, Sofiane
Selective synthesis of (3-ferrocenylprop-2-en-1-yl)triphenylphosphonium iodide: crystal structure determination of two polymorphs.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 376-381
2311881 CIF
Paper
C31 H28 Fe I PP 1 21/c 110.109; 10.6299; 25.148
90; 102.868; 90
2634.5Bouchene, Rafika; Daran, Jean Claude; Merazig, Hocine; Manoury, Eric; Bouacida, Sofiane
Selective synthesis of (3-ferrocenylprop-2-en-1-yl)triphenylphosphonium iodide: crystal structure determination of two polymorphs.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 376-381
2311882 CIF
Paper
C10 H12 Cl2 Co N4C 1 2/c 18.9262; 9.9679; 14.9683
90; 101.825; 90
1303.5Sanchez Montilva, Olga Carolina; Movilla, Federico; Rodriguez, Maricel Gabriela; Di Salvo, Florencia
Synthesis, crystal structure and study of the crystal packing in the complex bis(4-aminopyridine-κN<sup>1</sup>)dichloridocobalt(II).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 399-406
2311883 CIF
Paper
C20 H22 Cu N4 O8P 1 21/c 110.5788; 6.2806; 15.8478
90; 105.272; 90
1015.76Kocak, Cagdas; Oylumluoglu, Gorkem; Donmez, Adem; Coban, M. Burak; Erkarslan, Ugur; Aygun, Muhittin; Kara, Hulya
Crystal structure and photoluminescence properties of a new monomeric copper(II) complex: bis(3-{[(3-hydroxypropyl)imino]methyl}-4-nitrophenolato-κ<sup>3</sup>O,N,O')copper(II).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 414-419
2311884 CIF
Paper
C13 H13 Br N2 OP 1 21/n 14.7443; 39.332; 6.7618
90; 100.99; 90
1238.63Moore, John M.; Hall, Jasmine M.; Dilling, Wendell L.; Jensen, Anton W.; Squattrito, Philip J.; Giolando, Patrick; Kirschbaum, Kristin
N-Benzylnicotinamide and N-benzyl-1,4-dihydronicotinamide: useful models for NAD<sup>+</sup> and NADH.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 531-535
2311885 CIF
Paper
C13 H14 N2 OP 1 21/n 112.0186; 5.7435; 16.1124
90; 94.474; 90
1108.83Moore, John M.; Hall, Jasmine M.; Dilling, Wendell L.; Jensen, Anton W.; Squattrito, Philip J.; Giolando, Patrick; Kirschbaum, Kristin
N-Benzylnicotinamide and N-benzyl-1,4-dihydronicotinamide: useful models for NAD<sup>+</sup> and NADH.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 531-535
2311886 CIF
Paper
Al As3 H4 O11P n m a4.869; 11.071; 15.807
90; 90; 90
852.1Schwendtner, Karolina; Kolitsch, Uwe
M<sup>3+</sup>(H<sub>2</sub>AsO<sub>4</sub>)(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>) (M<sup>3+</sup> = Al, Ga) and In<sub>2</sub>(H<sub>2</sub>AsO<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>)<sub>2</sub>: a new layer structure type and a new framework structure type containing the rare H<sub>2</sub>As<sub>2</sub>O<sub>7</sub><sup>2-</sup> group.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 600-608
2311887 CIF
Paper
As3 Ga H4 O11P n m a4.916; 11.213; 15.853
90; 90; 90
873.9Schwendtner, Karolina; Kolitsch, Uwe
M<sup>3+</sup>(H<sub>2</sub>AsO<sub>4</sub>)(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>) (M<sup>3+</sup> = Al, Ga) and In<sub>2</sub>(H<sub>2</sub>AsO<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>)<sub>2</sub>: a new layer structure type and a new framework structure type containing the rare H<sub>2</sub>As<sub>2</sub>O<sub>7</sub><sup>2-</sup> group.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 600-608
2311888 CIF
Paper
As6 H8 In2 O22P 1 21/n 112.487; 11.529; 12.553
90; 101.4; 90
1771.5Schwendtner, Karolina; Kolitsch, Uwe
M<sup>3+</sup>(H<sub>2</sub>AsO<sub>4</sub>)(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>) (M<sup>3+</sup> = Al, Ga) and In<sub>2</sub>(H<sub>2</sub>AsO<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>As<sub>2</sub>O<sub>7</sub>)<sub>2</sub>: a new layer structure type and a new framework structure type containing the rare H<sub>2</sub>As<sub>2</sub>O<sub>7</sub><sup>2-</sup> group.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 600-608
2311889 CIF
Paper
C42 H83.6 Co N6 O11.8P -112.363; 12.6281; 16.3765
89.948; 95.46; 96.455
2528.86Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311890 CIF
Paper
C36 H54 Co N7 O11P 1 2/n 113.1679; 9.3413; 16.3388
90; 102.669; 90
1960.8Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311891 CIF
Paper
C36 H54 Co N7 O11P -112.9054; 9.3791; 16.129
88.724; 102.898; 88.528
1901.6Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311892 CIF
Paper
C36 H54 Co N7 O11P 1 2/n 113.0259; 9.3504; 16.3308
90; 103.847; 90
1931.24Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311893 CIF
Paper
C36 H54 Co N7 O11P 1 2/n 113.008; 9.332; 16.3753
90; 104.364; 90
1925.7Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311894 CIF
Paper
C36 H54 Co N7 O11P -113.0155; 9.4028; 16.264
88.794; 103.054; 88.687
1937.8Castro, Miguel; Falvello, Larry R.; Forcén-Vázquez, Elena; Guerra, Pablo; Al-Kenany, Nuha A; Martínez, Gema; Tomás, Milagros
A phase transition caught in mid-course: independent and concomitant analyses of the monoclinic and triclinic structures of (<sup>n</sup>Bu<sub>4</sub>N)[Co(orotate)<sub>2</sub>(bipy)]·3H<sub>2</sub>O.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 731-742
2311895 CIF
Paper
Au4 Y3R -3 :H13.3664; 13.3664; 5.964
90; 90; 120
922.8Celania, Chris; Smetana, Volodymyr; Mudring, Anja Verena
Crystal structures and new perspectives on Y<sub>3</sub>Au<sub>4</sub> and Y<sub>14</sub>Au<sub>51</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 692-696
2311896 CIF
Paper
Au51 Y14P 6/m12.5433; 12.5433; 9.1389
90; 90; 120
1245.2Celania, Chris; Smetana, Volodymyr; Mudring, Anja Verena
Crystal structures and new perspectives on Y<sub>3</sub>Au<sub>4</sub> and Y<sub>14</sub>Au<sub>51</sub>.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 692-696
2311897 CIF
Paper
C8 H10 F2 I N OP 1 21/n 14.9221; 8.4974; 24.1323
90; 91.61; 90
1008.94Lu, Norman; Wei, Rong Jyun; Chiang, Hsing Fang; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Weak hydrogen and halogen bonding in 4-[(2,2-difluoroethoxy)methyl]pyridinium iodide and 4-[(3-chloro-2,2,3,3-tetrafluoropropoxy)methyl]pyridinium iodide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 682-687
2311898 CIF
Paper
C9 H9 Cl F4 I N OP 1 21/n 15.3299; 27.5016; 8.3227
90; 91.813; 90
1219.34Lu, Norman; Wei, Rong Jyun; Chiang, Hsing Fang; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Weak hydrogen and halogen bonding in 4-[(2,2-difluoroethoxy)methyl]pyridinium iodide and 4-[(3-chloro-2,2,3,3-tetrafluoropropoxy)methyl]pyridinium iodide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 682-687
2311899 CIF
Paper
C22 H18 Fe2 O3C 1 c 15.9758; 36.456; 24.363
90; 91.997; 90
5304.3Tazi, Mehdi; Roisnel, Thierry; Mongin, Florence; Erb, William
Ferrocenecarboxylic anhydride: identification of a new polymorph.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 760-766
2311900 CIF
Paper
C32 H38 B2 Br2 F8 N6 Pd2P -17.8161; 11.3126; 12.2248
116.339; 99.6342; 98.3722
925Jandl, C.; Stegbauer, S.; Pöthig, A
A halide-free pyridinium-substituted η<sup>3</sup>-cycloheptatrienide-Pd complex.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 754-759
2311901 CIF
Paper
C18 H22 Br2 F8 N4 PdP 1 21/n 120.361; 8.9068; 24.876
90; 95.035; 90
4493.9Jandl, C.; Stegbauer, S.; Pöthig, A
A halide-free pyridinium-substituted η<sup>3</sup>-cycloheptatrienide-Pd complex.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 754-759
2311902 CIF
Paper
C11 H17 N5 O2P b c a12.5854; 10.0901; 19.8568
90; 90; 90
2521.6Durán-Palma, Melissa Hidekel; Mendoza-Barraza, Sonia Sanet; Magaña-Vergara, Nancy Evelyn; Martínez-Martínez, Francisco Javier; González-González, Juan Saulo
Crystal structure of pharmaceutical cocrystals of 2,6-diaminopyridine with piracetam and theophylline.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 767-772
2311903 CIF
Paper
C12 H15 N7 O2P 1 21/c 19.5439; 15.6588; 9.4887
90; 109.927; 90
1333.15Durán-Palma, Melissa Hidekel; Mendoza-Barraza, Sonia Sanet; Magaña-Vergara, Nancy Evelyn; Martínez-Martínez, Francisco Javier; González-González, Juan Saulo
Crystal structure of pharmaceutical cocrystals of 2,6-diaminopyridine with piracetam and theophylline.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 767-772
2311904 CIF
Paper
C10 H9 N3 O3 S2P 1 21/c 115.0609; 5.0408; 16.0954
90; 112.72; 90
1127.13Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Główka, Marek L
Planarity of benzoylthiocarbazate tuberculostatics. IV. Polymorphs of N'-(1,3-dithiolan-2-ylidene)-4-nitrobenzohydrazide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 797-802
2311905 CIF
Paper
C10 H9 N3 O3 S2P -15.0506; 8.0441; 14.1954
96.877; 95.134; 96.306
566.02Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Główka, Marek L
Planarity of benzoylthiocarbazate tuberculostatics. IV. Polymorphs of N'-(1,3-dithiolan-2-ylidene)-4-nitrobenzohydrazide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 797-802
2311906 CIF
Paper
C10 H9 N3 O3 S2P 1 21/c 17.8582; 6.1279; 24.4164
90; 98.211; 90
1163.7Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Główka, Marek L
Planarity of benzoylthiocarbazate tuberculostatics. IV. Polymorphs of N'-(1,3-dithiolan-2-ylidene)-4-nitrobenzohydrazide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 797-802
2311907 CIF
Paper
C10 H11 N3 O4 S2P 1 21/n 17.3654; 6.455; 25.8911
90; 90.808; 90
1230.84Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Główka, Marek L
Planarity of benzoylthiocarbazate tuberculostatics. IV. Polymorphs of N'-(1,3-dithiolan-2-ylidene)-4-nitrobenzohydrazide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 797-802
2311908 CIF
Paper
C52 H78 Mg2 O7P -112.014; 13.8692; 15.7804
84.797; 89.778; 74.914
2527.8Minyaev, Mikhail E.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Structural diversity of polynuclear Mg<sub>x</sub>O<sub>y</sub> cores in magnesium phenoxide complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 854-861
2311909 CIFC66 H90 Mg3 O8C 1 2/c 123.1969; 11.2068; 24.388
90; 100.344; 90
6236.9Minyaev, Mikhail E.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Structural diversity of polynuclear Mg<sub>x</sub>O<sub>y</sub> cores in magnesium phenoxide complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 854-861
2311910 CIFC42 H82 Mg4 N6 O8P 1 21/c 18.959; 20.4643; 13.5552
90; 94.318; 90
2478.2Minyaev, Mikhail E.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Structural diversity of polynuclear Mg<sub>x</sub>O<sub>y</sub> cores in magnesium phenoxide complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 854-861
2311911 CIF
Paper
C14 H17 N O4R -3 :H26.6774; 26.6774; 10.3451
90; 90; 120
6376.1Oburn, Shalisa M.; Bosch, Eric
Unexpected beauty and diversity in the structures of three homologous 4,5-dialkoxy-1-ethynyl-2-nitrobenzenes: the subtle interplay between intermolecular C-H...O hydrogen bonds and alkyl chain length.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 814-819
2311912 CIFC16 H21 N O4P 1 21/c 18.5209; 18.0914; 9.9579
90; 97.967; 90
1520.24Oburn, Shalisa M.; Bosch, Eric
Unexpected beauty and diversity in the structures of three homologous 4,5-dialkoxy-1-ethynyl-2-nitrobenzenes: the subtle interplay between intermolecular C-H...O hydrogen bonds and alkyl chain length.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 814-819
2311913 CIFC18 H25 N O4P -14.57; 9.415; 20.968
94.003; 90.758; 93.435
898.2Oburn, Shalisa M.; Bosch, Eric
Unexpected beauty and diversity in the structures of three homologous 4,5-dialkoxy-1-ethynyl-2-nitrobenzenes: the subtle interplay between intermolecular C-H...O hydrogen bonds and alkyl chain length.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 814-819
2311914 CIF
Paper
C18 H23 N O4P 1 21 18.4533; 10.238; 10.2552
90; 107.881; 90
844.66Maia, Angélica Faleiros da Silva; Martins, Felipe T.; Silva Neto, Leonardo da; Alves, Rosemeire Brondi; De Fátima, Ângelo
Cocaethylene, the in vivo product of cocaine and ethanol, is a narcotic more potent than its precursors.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 780-783
2311915 CIF
Paper
C54 H92 Cl Nd O14 P2C 1 2/c 116.9491; 12.3954; 30.5023
90; 105.11; 90
6186.7Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Zeynalova, Shadana Sh; Ananyev, Ivan V.; Churakov, Andrei V.
Isomorphous rare-earth bis[bis(2,6-diisopropylphenyl)phosphate] complexes and their self-assembly into two-dimensional frameworks by intramolecular hydrogen bonds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 820-827
2311916 CIF
Paper
C54 H92 Cl Lu O14 P2C 1 2/c 116.877; 12.443; 30.404
90; 104.231; 90
6188.9Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Zeynalova, Shadana Sh; Ananyev, Ivan V.; Churakov, Andrei V.
Isomorphous rare-earth bis[bis(2,6-diisopropylphenyl)phosphate] complexes and their self-assembly into two-dimensional frameworks by intramolecular hydrogen bonds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 820-827
2311917 CIF
Paper
C54 H92 Cl O14 P2 YC 1 2/c 116.9203; 12.3877; 30.3676
90; 104.708; 90
6156.6Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Zeynalova, Shadana Sh; Ananyev, Ivan V.; Churakov, Andrei V.
Isomorphous rare-earth bis[bis(2,6-diisopropylphenyl)phosphate] complexes and their self-assembly into two-dimensional frameworks by intramolecular hydrogen bonds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 820-827
2311918 CIF
Paper
C54 H92 N Nd O17 P2C 1 2/c 116.7581; 12.5821; 30.732
90; 104.876; 90
6262.7Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Zeynalova, Shadana Sh; Ananyev, Ivan V.; Churakov, Andrei V.
Isomorphous rare-earth bis[bis(2,6-diisopropylphenyl)phosphate] complexes and their self-assembly into two-dimensional frameworks by intramolecular hydrogen bonds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 820-827
2311919 CIF
Paper
C19 H19 N3 OP 1 21/c 17.811; 17.951; 11.405
90; 92.36; 90
1597.8Cuartas, Viviana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Reduced 3,4'-bipyrazoles from a simple pyrazole precursor: synthetic sequence, molecular structures and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 784-790
2311920 CIF
Paper
C27 H24 Br N3 OC 1 2/c 131.172; 10.039; 17.861
90; 123.334; 90
4670Cuartas, Viviana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Reduced 3,4'-bipyrazoles from a simple pyrazole precursor: synthetic sequence, molecular structures and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 784-790
2311921 CIF
Paper
C28 H27 N5 OP 1 21/c 111.321; 21.572; 9.55
90; 97.711; 90
2311Cuartas, Viviana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Reduced 3,4'-bipyrazoles from a simple pyrazole precursor: synthetic sequence, molecular structures and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 784-790
2311922 CIF
Paper
C31.89 H36.67 N5 O2.95P 1 21/n 19.363; 28.238; 10.775
90; 97.04; 90
2827Cuartas, Viviana; Insuasty, Braulio; Cobo, Justo; Glidewell, Christopher
Reduced 3,4'-bipyrazoles from a simple pyrazole precursor: synthetic sequence, molecular structures and supramolecular assembly.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 784-790
2311923 CIFC20 H18 Cd N4 O5C 1 c 18.6692; 21.933; 11.12
90; 110.77; 90
1977Yang, Huai Xia; Yang, Yan Qiu; Cheng, Di; Li, Ya Xue; Meng, Xiang Ru
A new two-dimensional Cd<sup>II</sup> coordination polymer based on 2-(1H-imidazol-1-ylmethyl)-6-methyl-1H-benzimidazole and benzene-1,2-dicarboxylate: synthesis, crystal structure and characterization.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 828-832
2311924 CIF
Paper
C7 H7 Cl OP 1 c 14.8622; 6.9718; 10.1539
90; 98.727; 90
340.21Jandl, Christian; Pöthig, Alexander
Hydroxytropylium chloride: the first crystal structure of an unfunctionalized hydroxytropylium ion.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 810-813
2311925 CIFC14 H13 Cl2 N O4 SP -19.7575; 11.0792; 15.5286
88.733; 83.753; 66.337
1528.02Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M.
Different supramolecular architectures mediated by different weak interactions in the crystals of three N-aryl-2,5-dimethoxybenzenesulfonamides.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 833-844
2311926 CIFC14 H13 Cl2 N O4 SP -17.4855; 8.1175; 13.9643
98.151; 95.566; 114.952
749.84Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M.
Different supramolecular architectures mediated by different weak interactions in the crystals of three N-aryl-2,5-dimethoxybenzenesulfonamides.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 833-844
2311927 CIFC16 H19 N O4 SP -18.2859; 8.7197; 12.232
70.522; 80.171; 78.856
812.1Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M.
Different supramolecular architectures mediated by different weak interactions in the crystals of three N-aryl-2,5-dimethoxybenzenesulfonamides.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 833-844
2311928 CIF
Paper
C10 H8 Cl8 N2 ZnP -18.6181; 12.8068; 16.7622
85.5267; 79.0539; 80.1701
1787.7Wang, Ai; Englert, Ulli
N-H...X (X = Cl and Br) hydrogen bonds in three isomorphous 3,5-dichloropyridinium salts.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 803-809
2311929 CIF
Paper
C10 H8 Br4 Cl4 N2 ZnP -18.8739; 13.469; 17.284
79.539; 78.468; 76.968
1951.7Wang, Ai; Englert, Ulli
N-H...X (X = Cl and Br) hydrogen bonds in three isomorphous 3,5-dichloropyridinium salts.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 803-809
2311930 CIF
Paper
C10 H8 Br4 Cl4 Co N2P -18.8698; 13.4808; 17.2853
79.5702; 78.4951; 76.8616
1952.3Wang, Ai; Englert, Ulli
N-H...X (X = Cl and Br) hydrogen bonds in three isomorphous 3,5-dichloropyridinium salts.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 803-809
2311931 CIF
Paper
Al0.46 As3 Ca0.77 Na Ni2.54 O12I m m a10.419; 13.496; 6.669
90; 90; 90
937.8Ben Smail, Ridha; Zid, Mohamed Faouzi
An arsenate with the α-CrPO<sub>4</sub> structure type, NaCa<sub>1-x</sub>Ni<sub>3-2x</sub>Al<sub>2x</sub>(AsO<sub>4</sub>)<sub>3</sub> (x = 0.23): crystal structure, charge-distribution and bond-valence-sum analyses.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 896-904
2311932 CIF
Paper
C26 H34 O6P 1 21/c 126.022; 7.41; 6.531
90; 94.377; 90
1255.7Geiger, David K.; Geiger, H. Cristina; Moore, Shawn M.; Roberts, William R.
Structural characterization, gelation ability, and energy-framework analysis of two bis(long-chain ester)-substituted 4,4'-biphenyl compounds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 791-796
2311933 CIF
Paper
C28 H38 O6P 1 21/c 126.594; 7.5344; 6.5302
90; 95.872; 90
1301.6Geiger, David K.; Geiger, H. Cristina; Moore, Shawn M.; Roberts, William R.
Structural characterization, gelation ability, and energy-framework analysis of two bis(long-chain ester)-substituted 4,4'-biphenyl compounds.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 791-796
2311934 CIF
Paper
C56 H60 Cl2 F24 N28 Ni3 P4P -111.8775; 13.3374; 13.9741
66.056; 73.926; 65.297
1822.6Altmann, Philipp J.; Ehrenreich, Michael; Pöthig, Alexander
A hybrid imidazolylidene/imidazolium nickel NHC complex: an isolated intermediate.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 880-884
2311935 CIF
Paper
C10 H12 Br2 F8 N2P 1 21/c 113.4659; 11.0854; 10.7955
90; 106.271; 90
1546.95Brisdon, Alan K.; Muneer, Abeer M. T.; Pritchard, Robin G.
Halogen bonding in a series of Br(CF<sub>2</sub>)<sub>n</sub>Br-DABCO adducts (n = 4, 6, 8).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 874-879
2311936 CIF
Paper
C12 H12 Br2 F12 N2P -16.0096; 10.4941; 14.5016
92.051; 101.375; 90.507
895.89Brisdon, Alan K.; Muneer, Abeer M. T.; Pritchard, Robin G.
Halogen bonding in a series of Br(CF<sub>2</sub>)<sub>n</sub>Br-DABCO adducts (n = 4, 6, 8).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 874-879
2311937 CIF
Paper
C14 H12 Br2 F16 N2P -16.03367; 10.4836; 16.4471
88.785; 84.126; 89.724
1034.66Brisdon, Alan K.; Muneer, Abeer M. T.; Pritchard, Robin G.
Halogen bonding in a series of Br(CF<sub>2</sub>)<sub>n</sub>Br-DABCO adducts (n = 4, 6, 8).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 874-879
2311938 CIF
Paper
C16 H40 Cl6 Cu3 N4 O18P 1 21/c 112.946; 12.568; 11.044
90; 115.18; 90
1626.2Bouheroum, Sofiane; Cherouana, Aouatef; Beghidja, Adel; Dahaoui, Slimane; Rabu, Pierre
A new copper(II) coordination polymer containing chains of interconnected paddle-wheel antiferromagnetic clusters.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1050-1055
2311939 CIFC16 H14 Cl2 F6 N2 O2 PdP 1 21/c 19.218; 17.4137; 12.1884
90; 100.992; 90
1920.6Lu, Norman; Zheng, Jing Hung; Lu, Yi Jing; Chiang, Hsing Fang; Chu, Chun Wei; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Side-chain conformations in the isomorphous polyfluorinated {4,4'-bis[(2,2-difluoroethoxy)methyl]-2,2'-bipyridine-κ<sup>2</sup>N,N'}dichloridopalladium and -platinum complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 930-936
2311940 CIFC16 H14 Cl2 F6 N2 O2 PtP 1 21/c 19.274; 17.393; 12.319
90; 100.352; 90
1954.7Lu, Norman; Zheng, Jing Hung; Lu, Yi Jing; Chiang, Hsing Fang; Chu, Chun Wei; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Side-chain conformations in the isomorphous polyfluorinated {4,4'-bis[(2,2-difluoroethoxy)methyl]-2,2'-bipyridine-κ<sup>2</sup>N,N'}dichloridopalladium and -platinum complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 930-936
2311941 CIF
Paper
C16 H16 Cl2 F4 N2 O2 PdP b c a7.7401; 16.5086; 28.3013
90; 90; 90
3616.29Lu, Norman; Zheng, Jing Hung; Lu, Yi Jing; Chiang, Hsing Fang; Chu, Chun Wei; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Side-chain conformations in the isomorphous polyfluorinated {4,4'-bis[(2,2-difluoroethoxy)methyl]-2,2'-bipyridine-κ<sup>2</sup>N,N'}dichloridopalladium and -platinum complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 930-936
2311942 CIF
Paper
C16 H16 Cl2 F4 N2 O2 PtP b c a7.7215; 16.5892; 28.1692
90; 90; 90
3608.29Lu, Norman; Zheng, Jing Hung; Lu, Yi Jing; Chiang, Hsing Fang; Chu, Chun Wei; Thrasher, Joseph S.; Wen, Yuh Sheng; Liu, Ling Kang
Side-chain conformations in the isomorphous polyfluorinated {4,4'-bis[(2,2-difluoroethoxy)methyl]-2,2'-bipyridine-κ<sup>2</sup>N,N'}dichloridopalladium and -platinum complexes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 930-936
2311943 CIF
Paper
C38 H46 Cu N14 O15 S2P 1 21/c 124.39; 11.871; 16.048
90; 96.325; 90
4618.2Chu, Xin; Zhang, Kou Lin
Preparation and characterization of two new Cu<sup>II</sup> supramolecular coordination polymers incorporating sulfobenzoate and flexible heterocyclic ligands.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1087-1097
2311944 CIF
Paper
C28 H40 Cu2 N6 O18 S2P 1 21/c 113.4947; 10.1948; 18.8909
90; 134.327; 90
1859.2Chu, Xin; Zhang, Kou Lin
Preparation and characterization of two new Cu<sup>II</sup> supramolecular coordination polymers incorporating sulfobenzoate and flexible heterocyclic ligands.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1087-1097
2311945 CIF
Paper
C4 H4 N2 O SP 1 21/c 14.1043; 11.0458; 12.0465
90; 93.74; 90
544.97Fabijanić, Ivana; Matković-Čalogović, Dubravka; Pilepić, Viktor; Sanković, Krešimir
Structural and computational analysis of intermolecular interactions in a new 2-thiouracil polymorph.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1078-1086
2311946 CIF
Paper
Ag K7 O16 W4P 63 m c12.4912; 12.4912; 7.4526
90; 90; 120
1007.04Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G.
Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1071-1077
2311947 CIF
Paper
Ag1.32 K6.68 Mo4 O16P 63 m c12.4188; 12.4188; 7.4338
90; 90; 120
992.89Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G.
Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1071-1077
2311948 CIF
Paper
C17 H21 N O8P -16.9085; 8.4524; 17.9702
101.801; 92.711; 109.829
958.47Cvetkovski, Aleksandar; Ferretti, Valeria; Bertolasi, Valerio
New pharmaceutical salts containing pyridoxine.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1064-1070
2311949 CIF
Paper
C18 H23 N O8P 1 21 17.244; 17.1615; 7.2706
90; 98.806; 90
893.21Cvetkovski, Aleksandar; Ferretti, Valeria; Bertolasi, Valerio
New pharmaceutical salts containing pyridoxine.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1064-1070
2311950 CIF
Paper
C19 H13 Br N2 OP -19.188; 9.308; 10.887
113.56; 90.782; 116.173
745.3García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311951 CIF
Paper
C19 H15 Br N2 OP 1 21/n 113.728; 14.901; 15.507
90; 92.165; 90
3170García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311952 CIF
Paper
C25 H19 Br N2 OP -110.912; 12.544; 15.583
89.23; 79.49; 73.2
2006García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311953 CIF
Paper
C22 H17 Br N2 O3C 1 2/c 119.406; 8.773; 23.028
90; 103.318; 90
3815García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311954 CIF
Paper
C32 H23 Br N2 O2P 1 21/c 114.886; 8.129; 21.432
90; 104.638; 90
2509.3García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311955 CIF
Paper
C16 H10 Br N OP 1 21/n 110.986; 8.977; 13.209
90; 97.14; 90
1292.6García, Andrés C; Abonía, Rodrigo; Jaramillo-Gómez, Luz M; Cobo, Justo; Glidewell, Christopher
Design, synthesis and crystallographic study of novel indole-based cyano derivatives as key building blocks for heteropolycyclic compounds of major complexity.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1040-1049
2311956 CIF
Paper
C38 H84 Cu5 I18 N4 Pb6 S4P -113.5451; 13.889; 14.4514
94.449; 92.316; 119.009
2361Fan, Le Qing; Zhu, Xiao Tong
Syntheses and crystal structures of two heterometallic iodoplumbates containing mixed-valence copper(I/II).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1098-1103
2311957 CIF
Paper
C24 H16 Cu2 I6 N4 PbC 1 2/m 117.5853; 18.1041; 13.0705
90; 128.789; 90
3243.5Fan, Le Qing; Zhu, Xiao Tong
Syntheses and crystal structures of two heterometallic iodoplumbates containing mixed-valence copper(I/II).
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1098-1103
2311958 CIF
Paper
C16 H9 Cl5 N O3P -17.1681; 9.28821; 13.42132
88.3124; 85.6481; 69.7508
835.927Sridhar, Balasubramanian; Ravikumar, Krishnan
Role of halogen-halogen contacts in the crystal structures of three new solvates of the drug oxyclozanide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1056-1063
2311959 CIF
Paper
C17 H11 Cl5 N O3P -17.12429; 9.40484; 14.27988
83.7014; 80.0916; 67.8388
871.84Sridhar, Balasubramanian; Ravikumar, Krishnan
Role of halogen-halogen contacts in the crystal structures of three new solvates of the drug oxyclozanide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1056-1063
2311960 CIF
Paper
C16.5 H10 Cl5 N O3P -16.92017; 9.71946; 13.98498
86.3845; 85.4687; 65.8069
854.849Sridhar, Balasubramanian; Ravikumar, Krishnan
Role of halogen-halogen contacts in the crystal structures of three new solvates of the drug oxyclozanide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1056-1063
2311961 CIF
Paper
C16 H8.5 Cl5.5 N O3P -16.90927; 9.69846; 13.97198
86.5557; 85.9678; 65.8305
851.561Sridhar, Balasubramanian; Ravikumar, Krishnan
Role of halogen-halogen contacts in the crystal structures of three new solvates of the drug oxyclozanide.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1056-1063
2311962 CIF
Paper
C12 H8 Au K N4P 1 21 13.72856; 18.8381; 9.1981
90; 101.337; 90
633.46Döring, Cindy; Strey, Mark; Jones, Peter G.
The march of progress: structures of the adducts of potassium dicyanidoaurate(I) with 2,2'-bipyridyl (redetermination) and 1,10-phenanthroline.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1104-1108
2311963 CIF
Paper
C14 H8 Au K N4C 1 2/c 141.202; 3.67714; 19.5967
90; 116.232; 90
2663.2Döring, Cindy; Strey, Mark; Jones, Peter G.
The march of progress: structures of the adducts of potassium dicyanidoaurate(I) with 2,2'-bipyridyl (redetermination) and 1,10-phenanthroline.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1104-1108
2311964 CIF
Paper
C9 H13 N5 O4P 1 21/c 14.6448; 15.632; 14.13
90; 91.632; 90
1025.5Roque-Flores, Roxana L; Guzei, Ilia A.; Matos, Jivaldo do Rosario; Yu, Lian
Polymorphs of the antiviral drug ganciclovir.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1116-1120
2311965 CIF
Paper
C28 H32 N2 O4R -3 :R19.9182; 19.9182; 19.9182
116.98; 116.98; 116.98
3496.4Quiroga, Jairo; Romo, Pablo; Cobo, Justo; Glidewell, Christopher
Synthesis of spiro[indoline-3,3'-pyrrolizines] by 1,3-dipolar reactions between isatins, L-proline and electron-deficient alkenes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1109-1115
2311966 CIF
Paper
C28.981 H21.962 Cl5.962 N2 O3P 1 21/c 112.8; 12.511; 18.638
90; 99.325; 90
2945.3Quiroga, Jairo; Romo, Pablo; Cobo, Justo; Glidewell, Christopher
Synthesis of spiro[indoline-3,3'-pyrrolizines] by 1,3-dipolar reactions between isatins, L-proline and electron-deficient alkenes.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1109-1115
2311967 CIF
Paper
C48 H40 Cl12 N8 O Zn3P -111.0485; 16.0249; 16.4318
100.824; 103.574; 102.737
2668.9Granifo, Juan; Suárez, Sebastián; Boubeta, Fernando; Baggio, Ricardo
Crystallographic and computational study of a network composed of [ZnCl<sub>4</sub>]<sup>2-</sup> anions and triply protonated 4'-functionalized terpyridine cations.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1121-1130
2311968 CIF
Paper
C45 H50 Br2 Cl2 I10 N4 Pd2P -19.1277; 13.5001; 14.6344
113.316; 103.239; 100.711
1533Jandl, Christian; Pöthig, Alexander
Dimerization of a mixed-carbene Pd<sup>II</sup> dibromide complex by elemental iodine.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1131-1136
2311969 CIF
Paper
C22 H24 Cl N5 O4P 1 21/c 122.622; 7.1937; 13.5315
90; 103.499; 90
2141.23Żesławska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Conformational study of (Z)-5-(4-chlorobenzylidene)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-3H-imidazol-4(5H)-one in different environments: insight into the structural properties of bacterial efflux pump inhibitors.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1151-1157
2311970 CIF
Paper
C24 H26 Cl N5 O6P -17.8667; 11.9015; 14.4406
66.859; 85.085; 81.332
1228.51Żesławska, Ewa; Nitek, Wojciech; Handzlik, Jadwiga
Conformational study of (Z)-5-(4-chlorobenzylidene)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-3H-imidazol-4(5H)-one in different environments: insight into the structural properties of bacterial efflux pump inhibitors.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1151-1157
2311971 CIF
Paper
C6 H11 N5 O S3 ZnP 1 21/c 110.0831; 17.4525; 7.6133
90; 99.48; 90
1321.46Swiatkowski, Marcin; Kruszynski, Rafal
New fluorescent compounds based on zinc thiocyanate: influence of structure on spectral properties.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1144-1150
2311972 CIF
Paper
C8 H20 N12 O6 S4 Zn2C 1 2/c 121.8246; 5.0239; 21.6451
90; 90.074; 90
2373.27Swiatkowski, Marcin; Kruszynski, Rafal
New fluorescent compounds based on zinc thiocyanate: influence of structure on spectral properties.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1144-1150
2311973 CIF
Paper
C14 H20 O3P -17.9565; 8.5027; 11.0842
77.857; 76.632; 62.158
640.51Suárez, Sebastián; Manzano, Veronica E.; Fantoni, Adolfo C.; Halac, Emilia; Baggio, Ricardo; Cukiernik, Fabio D.
A combined crystallographic, thermal, Raman and computational study on polymorphism and phase transition in 1-(4-hexyloxy-3-hydroxyphenyl)ethanone.
Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1137-1143
2311974 CIF
Paper
C38 H38 Co N12 O14P -17.356; 11.589; 12.0655
73.757; 88.232; 83.876
981.9Atria, Ana María; Parada, José; Moreno, Yanko; Suárez, Sebastián; Baggio, Ricardo; Peña, Octavio
Synthesis, crystal structure and magnetic properties of diaquabis(2,6-diamino-7H-purin-1-ium-κN<sup>9</sup>)bis(4,4'-oxydibenzoato-κO)cobalt(II) dihydrate.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 37-44
2311975 CIF
Paper
C17 H13 Br3 N2P -111.965; 12.595; 13.667
114.497; 106.139; 93.912
1760.2Tammisetti, Renuka Devi; Kosilkin, Ilya V.; Guzei, Ilia A.; Khrustalev, Victor N.; Dalton, Larry; Timofeeva, Tatiana V.
Z/E-Isomerism of 3-[4-(dimethylamino)phenyl]-2-(2,4,6-tribromophenyl)acrylonitrile: crystal structures and secondary intermolecular interactions.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 69-74
2311976 CIF
Paper
C17 H13 Br3 N2P 1 21/n 19.082; 13.024; 14.266
90; 101.467; 90
1653.8Tammisetti, Renuka Devi; Kosilkin, Ilya V.; Guzei, Ilia A.; Khrustalev, Victor N.; Dalton, Larry; Timofeeva, Tatiana V.
Z/E-Isomerism of 3-[4-(dimethylamino)phenyl]-2-(2,4,6-tribromophenyl)acrylonitrile: crystal structures and secondary intermolecular interactions.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 69-74
2311977 CIF
Paper
O9 Sr3 W2C 1 2/c 19.637; 5.564; 13.763
90; 103.497; 90
717.6Urushihara, Daisuke; Asaka, Toru; Fukuda, Koichiro; Sakurai, Hiroya
High-pressure synthesis and crystal structure of the strontium tungstate Sr<sub>3</sub>W<sub>2</sub>O<sub>9</sub>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 120-124
2311978 CIF
Paper
O9 Sr3 W2C 1 2/c 19.627; 5.558; 13.732
90; 103.514; 90
714.4Urushihara, Daisuke; Asaka, Toru; Fukuda, Koichiro; Sakurai, Hiroya
High-pressure synthesis and crystal structure of the strontium tungstate Sr<sub>3</sub>W<sub>2</sub>O<sub>9</sub>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 120-124
2311979 CIF
Paper
C5 Cl5 N OP 1 21/c 18.5852; 17.0639; 5.9883
90; 106.936; 90
839.22Wzgarda-Raj, Kinga; Rybarczyk-Pirek, Agnieszka J; Wojtulewski, Sławomir; Palusiak, Marcin
N-Oxide-N-oxide interactions and Cl...Cl halogen bonds in pentachloropyridine N-oxide: the many-body approach to interactions in the crystal state.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 113-119
2311980 CIF
Paper
Ce0.8 Gd0.1 Ho0.1 O1.9F m -3 m5.4214; 5.4214; 5.4214
90; 90; 90
159.34Rahayu, Sri; Forrester, Jennifer S.; Kale, Girish M.; Ghadiri, Mojtaba
Promising solid electrolyte material for an IT-SOFC: crystal structure of the cerium gadolinium holmium oxide Ce<sub>0.8</sub>Gd<sub>0.1</sub>Ho<sub>0.1</sub>O<sub>1.9</sub> between 295 and 1023 K.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 236-239
2311981 CIF
Paper
C20 H20 N4 Ni O4 SP 1 21/c 19.637; 18.0065; 12.4723
90; 109.396; 90
2041.5Roy, Mrittika; Pham, Duyen N. K.; Kreider-Mueller, Ava; Golen, James A.; Manke, David R.
First-row transition metal-pyridine (py)-sulfate [(py)<sub>x</sub>M](SO<sub>4</sub>) complexes (M = Ni, Cu and Zn): crystal field theory in action.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 263-268
2311982 CIF
Paper
C30 H30 Cu2 N6 O8 S2P 1 21/c 19.0147; 18.5456; 9.6355
90; 108.191; 90
1530.38Roy, Mrittika; Pham, Duyen N. K.; Kreider-Mueller, Ava; Golen, James A.; Manke, David R.
First-row transition metal-pyridine (py)-sulfate [(py)<sub>x</sub>M](SO<sub>4</sub>) complexes (M = Ni, Cu and Zn): crystal field theory in action.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 263-268
2311983 CIF
Paper
C30 H30 N6 O8 S2 Zn2P 31 2 110.5383; 10.5383; 26.135
90; 90; 120
2513.6Roy, Mrittika; Pham, Duyen N. K.; Kreider-Mueller, Ava; Golen, James A.; Manke, David R.
First-row transition metal-pyridine (py)-sulfate [(py)<sub>x</sub>M](SO<sub>4</sub>) complexes (M = Ni, Cu and Zn): crystal field theory in action.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 263-268
2311984 CIF
Paper
C14 H19 Au I2 N2P 1 2/c 115.527; 7.46802; 17.0254
90; 116.528; 90
1766.35Döring, Cindy; Sui, Zhihong; Jones, Peter G.
3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)<sub>2</sub>H]<sup>+</sup>·[AuI<sub>2</sub>]<sup>-</sup> and of two polymorphs of [(3,4-lut)<sub>2</sub>H<sup>+</sup>]<sub>2</sub>·[AuI<sub>2</sub>]<sup>-</sup>·I<sup/>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 289-294
2311985 CIF
Paper
C28 H38 Au I3 N4P 1 21 17.7528; 14.5978; 14.4806
90; 102.552; 90
1599.66Döring, Cindy; Sui, Zhihong; Jones, Peter G.
3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)<sub>2</sub>H]<sup>+</sup>·[AuI<sub>2</sub>]<sup>-</sup> and of two polymorphs of [(3,4-lut)<sub>2</sub>H<sup>+</sup>]<sub>2</sub>·[AuI<sub>2</sub>]<sup>-</sup>·I<sup/>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 289-294
2311986 CIF
Paper
C28 H38 Au I3 N4P 1 c 17.741; 14.6209; 14.0721
90; 92.155; 90
1591.56Döring, Cindy; Sui, Zhihong; Jones, Peter G.
3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)<sub>2</sub>H]<sup>+</sup>·[AuI<sub>2</sub>]<sup>-</sup> and of two polymorphs of [(3,4-lut)<sub>2</sub>H<sup>+</sup>]<sub>2</sub>·[AuI<sub>2</sub>]<sup>-</sup>·I<sup/>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 289-294
2311987 CIF
Paper
C10 H10 Au2 I2 N2P n n m7.1692; 14.2434; 14.7445
90; 90; 90
1505.62Döring, Cindy; Sui, Zhihong; Jones, Peter G.
3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)<sub>2</sub>H]<sup>+</sup>·[AuI<sub>2</sub>]<sup>-</sup> and of two polymorphs of [(3,4-lut)<sub>2</sub>H<sup>+</sup>]<sub>2</sub>·[AuI<sub>2</sub>]<sup>-</sup>·I<sup/>.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 289-294
2311988 CIF
Paper
C22 H18 N4 O4P 1 21/c 17.252; 19.7485; 14.0347
90; 95.058; 90
2002.17Dammene Debbih, Ouafa; Sid, Assia; Bouchene, Rafika; Bouacida, Sofiane; Mazouz, Wissam; Gherraf, Noureddine
Two hydrazones derived from 1-aryl-3-(p-substituted phenyl)prop-2-en-1-one: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 703-714
2311989 CIF
Paper
C25 H17 Cl N4 O4P 1 21/c 17.3922; 20.9233; 14.7828
90; 100.571; 90
2247.6Dammene Debbih, Ouafa; Sid, Assia; Bouchene, Rafika; Bouacida, Sofiane; Mazouz, Wissam; Gherraf, Noureddine
Two hydrazones derived from 1-aryl-3-(p-substituted phenyl)prop-2-en-1-one: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 703-714
2311990 CIF
Paper
C18 H50 K Mo8 N3 O27C 1 2/c 125.1247; 10.7583; 18.5442
90; 121.835; 90
4258.5Paul, Shounik; Sreejith, S. S.; Roy, Soumyajit
pH-induced phase transition and crystallization of soft-oxometalates (SOMs) into polyoxometalates (POMs): a study on crystallization from colloids.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1274-1283
2311991 CIF
Paper
C22 H18 N2 O2P 1 21/c 110.265; 8.0342; 23.4156
90; 102.512; 90
1885.2Tan, Xue Jie; Wang, Di; Lei, Xu Gang; Chen, Jun Peng
Theoretical insight into the disordered structure of (Z)-2-[(E)-(4-methoxybenzylidene)hydrazinylidene]-1,2-diphenylethanone: the role of noncovalent interactions.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1058-1067
2311992 CIF
Paper
C22 H18 N2 O2P 1 21/c 110.2458; 8.007; 23.3695
90; 102.461; 90
1872.03Tan, Xue Jie; Wang, Di; Lei, Xu Gang; Chen, Jun Peng
Theoretical insight into the disordered structure of (Z)-2-[(E)-(4-methoxybenzylidene)hydrazinylidene]-1,2-diphenylethanone: the role of noncovalent interactions.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1058-1067
2311993 CIFC6 H8 Li O8 RbP 1 21/a 123.1577; 6.49992; 6.49067
90; 99.6112; 90
963.28Cigler, Andrew J.; Kaduk, James A.
Dilithium (citrate) crystals and their relatives.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170
2311994 CIFC6 H6 Li2 O7P -16.5872; 6.2997; 9.8321
93.898; 106.056; 97.624
386.27Cigler, Andrew J.; Kaduk, James A.
Dilithium (citrate) crystals and their relatives.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170
2311995 CIFC6 H6 Li Na O7P -16.5811; 6.357; 9.9389
91.762; 104.388; 97.438
398.52Cigler, Andrew J.; Kaduk, James A.
Dilithium (citrate) crystals and their relatives.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170
2311996 CIFC6 H6 K Li O7P -16.2771; 6.3166; 10.8323
93.054; 102.747; 96.054
415.28Cigler, Andrew J.; Kaduk, James A.
Dilithium (citrate) crystals and their relatives.
Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170
2311997 CIFC17 H14 Cl2 N2 O2B -116.7989; 17.0054; 22.1341
78.897; 100.411; 90.042
6098.8Garraza, María Soledad; Gimenez, María Emilia; Vega, Daniel Roberto; Baggio, Ricardo
Crystal structure and pseudosymmetry analysis of the triclinic prodrug cloxazolam (Z' = 4).
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 851-858
2311998 CIF
Paper
C63 H63 Eu O27R 3 :H27.194; 27.194; 7.6221
90; 90; 120
4881.5Han, Mei Rong; Li, Shao Dong; Ma, Ling; Yao, Bang; Feng, Si Si; Zhu, Miao Li
Luminescent and magnetic bifunctional coordination complex based on a chiral tartaric acid derivative and europium.
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1220-1227
2311999 CIF
Paper
C126 H126 N14 Nb2C 1 2/c 132.077; 15.83; 24.815
90; 97.655; 90
12488Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E.
Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0).
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265
2312000 CIF
Paper
C120 H132 N12 Nb2 O3P -112.2029; 12.5921; 19.676
95.62; 101.807; 113.236
2665.2Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E.
Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0).
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265
2312001 CIF
Paper
C78 H102 N6 NbR -3 :H15.2582; 15.2582; 26.7313
90; 90; 120
5389.6Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E.
Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0).
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265
2312002 CIF
Paper
C17 H13 N O4P 1 21/n 112.5596; 7.587; 14.3433
90; 94.66; 90
1362.25Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached
Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives.
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627
2312003 CIF
Paper
C17 H13 N O4P 21 21 2125.8641; 13.2022; 4.05295
90; 90; 90
1383.93Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached
Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives.
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627
2312004 CIF
Paper
C17 H15 N O5P 21 21 2125.2195; 12.8116; 4.54932
90; 90; 90
1469.9Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached
Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives.
Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627
2312027 CIF
HKL
Paper
C12 H16 Ca N2 O9P -16.661; 9.833; 12.612
74.277; 79.224; 84.609
780.3Liu, Huang Huang; Liang, Chu Heng; Liu, Yan; Zhang, Hong Tao
A two-dimensional calcium (II) coordination polymer constructed from 2,2'-[terephthaloylbis(azanediyl)]diacetate: synthesis, structure and properties.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 675-682
2312035 CIF
Paper
C16 H10 F4 I2 N2 S2P 1 21/c 116.288; 5.79; 10.546
90; 104.77; 90
961.7Mosquera, Marta E. G.; Dortez, Silvia; Fernández-Palacio, Francisco; Gómez-Sal, Pilar
Pyridine-4-thiol as halogen-bond (HaB) acceptor: influence of the noncovalent interaction in its reactivity.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 112-117
2312036 CIF
Paper
C11 H12 Cl2 N2 S2F 2 d d8.0815; 17.2161; 18.9254
90; 90; 90
2633.1Mosquera, Marta E. G.; Dortez, Silvia; Fernández-Palacio, Francisco; Gómez-Sal, Pilar
Pyridine-4-thiol as halogen-bond (HaB) acceptor: influence of the noncovalent interaction in its reactivity.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 112-117
2312037 CIF
HKL
Paper
C14 H23 F I Nb Si2C 1 2/c 115.1427; 8.9369; 26.143
90; 98.304; 90
3500.8Rodriguez, Sara M.; Motta, Ysidro N.; Hill, Michael R.; Oelke, Laura M.; Carter, Carly C.; Cundari, Thomas R.; Yousufuddin, Muhammed
Crystal structure and DFT calculations of Cp<sub>2</sub>NbH(SiIMe<sub>2</sub>)(SiFMe<sub>2</sub>): an asymmetric bis(silyl) niobocene hydride complex.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 158-163
2312038 CIF
HKL
Paper
C21 H25 Cu2 N3 O4P -18.0549; 9.8811; 13.7189
106.451; 103.271; 91.482
1014.4Ranaweera, Samantha A.; Donnadieu, Bruno; Henry, William P.; White, Mark G.
Effects of electron-donating ability of binding sites on coordination number: the interactions of a cyclic Schiff base with copper ions.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 142-148
2312039 CIF
HKL
Paper
C29 H18 F4 N4 O4P 1 21/c 123.8353; 6.8067; 16.6103
90; 109.104; 90
2546.43Bosch, Eric; Moreno, Bryce S.; Bowling, Nathan P.
π-Complexation and C-H hydrogen bonding in the formation of colored cocrystals.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 149-157
2312040 CIF
HKL
Paper
C29 H18 F4 N4 O4P b c n13.131; 14.423; 26.523
90; 90; 90
5023Bosch, Eric; Moreno, Bryce S.; Bowling, Nathan P.
π-Complexation and C-H hydrogen bonding in the formation of colored cocrystals.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 149-157
2312043 CIF
HKL
Paper
C26 H20 Cl2 N4P -16.1037; 9.3345; 10.4146
83.039; 77.139; 85.055
573.15Parkin, Sean; Glidewell, Christopher; Horton, Peter N.
(E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82
2312044 CIF
HKL
Paper
C26 H20 Cl2 N4C 1 c 122.657; 5.4399; 19.086
90; 99.967; 90
2316.9Parkin, Sean; Glidewell, Christopher; Horton, Peter N.
(E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82
2312045 CIF
HKL
Paper
C26 H20 Cl2 N4C 1 2/c 122.657; 5.4399; 19.086
90; 99.967; 90
2316.9Parkin, Sean; Glidewell, Christopher; Horton, Peter N.
(E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82
2312046 CIF
HKL
Paper
C25 H19 NP 1 21/c 112.6112; 8.6352; 17.308
90; 105.925; 90
1812.51Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103
2312047 CIF
HKL
Paper
C25 H17 Cl2 NC 1 2/c 128.495; 9.5384; 16.052
90; 118.581; 90
3831.2Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103
2312048 CIF
HKL
Paper
C32 H22 Br N OP 1 21/n 112.287; 15.528; 12.844
90; 99.877; 90
2414.2Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103
2312049 CIF
HKL
Paper
C32 H21 Br Cl N OP -19.9051; 11.3936; 11.8192
77.727; 76.116; 86.448
1265.2Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103
2312050 CIF
HKL
Paper
C30 H20 Br N O SP b c a15.5785; 16.4215; 18.3126
90; 90; 90
4684.8Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103
2312077 CIF
HKL
Paper
C8 H14 N8 O4P -17.1203; 7.2221; 7.3808
96.813; 106.031; 114.329
320.47Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.
Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185
2312078 CIF
HKL
Paper
C10 H16 N8 O4C 1 2/c 114.5686; 7.1704; 13.9658
90; 104.209; 90
1414.27Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.
Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185
2312079 CIF
HKL
Paper
C10 H18 N8 O4C 1 2/c 116.4095; 6.7848; 14.8471
90; 116.556; 90
1478.61Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.
Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185
2312080 CIF
HKL
Paper
C12 H22 N8 O4P 1 21/c 14.6121; 16.8608; 10.7931
90; 93.853; 90
837.41Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B.
Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185
2312081 CIF
HKL
Paper
C132 H192 B4 N12P -115.5952; 15.7968; 25.7779
74.729; 85.878; 89.857
6109.5Lovstedt, Alex; Dempsey, Stephen H.; Kass, Steven R.
Structure determination of a bis[4-(di-n-butylamino)phenyl](pyridin-3-yl)borane tetramer highlighting a unique geometric conformation of the core 16-membered ring.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 170-176
2312083 CIF
HKL
Paper
C18 H42 O21P 21 21 218.8921; 12.2495; 23.798
90; 90; 90
2592.2Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi
Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748
2312084 CIF
HKL
Paper
C18 H40 O20P 21 21 218.987; 12.3973; 23.528
90; 90; 90
2621.4Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi
Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748
2312085 CIF
HKL
Paper
C10 H12 N2 O4 SP 1 21/n 18.6173; 14.6662; 9.4885
90; 108.075; 90
1140.01Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312086 CIF
HKL
Paper
C11 H14 N2 O4 SP 1 21/n 18.6881; 15.0266; 9.8337
90; 106.526; 90
1230.8Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312087 CIF
HKL
Paper
C14 H12 N2 O4 SP 1 21/n 17.4701; 23.6743; 7.8614
90; 94.989; 90
1385.02Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312088 CIF
HKL
Paper
C10 H14 N2 O2 SP 1 21/c 116.399; 7.9485; 18.376
90; 113.907; 90
2189.8Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312089 CIF
HKL
Paper
C11 H16 N2 O2 SP b c a11.1747; 10.485; 20.1368
90; 90; 90
2359.36Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312090 CIF
HKL
Paper
C14 H14 N2 O2 SP 1 21/n 19.799; 10.2612; 13.201
90; 100.682; 90
1304.4Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B.
N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742
2312091 CIF
HKL
Paper
C25 H20 Cu N4 O8P -110.4795; 11.1326; 12.1768
101.393; 105.793; 115.958
1143.78Bhat, Satish Shantaram; Kawade, Vitthal A.; Revankar, Vidyanand K.; Kumbar, Vijay; Bhat, Kishore
Synthesis, crystal structure and biological properties of a fluorophore-labelled mixed-ligand copper(II) complex incorporating N-hydroxynaphthalene-1,8-dicarboximide.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 755-759
2312092 CIF
HKL
Paper
Cl H2 K OP 1 21/n 15.687; 6.3969; 8.447
90; 107.08; 90
293.7Yamashita, Keishiro; Komatsu, Kazuki; Kagi, Hiroyuki
Crystal structure of potassium chloride monohydrate: water intercalation into the B1 structure of KCl under high pressure.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 749-754
2312093 CIF
HKL
Paper
C55 H41 Cu F6 N P3P -111.0585; 12.0918; 19.5318
73.751; 74.975; 74.263
2365.4Zhang, Dan Qi; Song, Li; Wu, Jin Tao; Zhu, Yu Fan; Xu, Wen Ze; Lai, Jia Qi; Chai, Wen Xiang
Structural, spectroscopic, luminescence sensing and TD-DFT theoretical studies of a CuP<sub>2</sub>N-type complex.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 186-192
2312094 CIF
HKL
Paper
C17 H16 Cl N2 O2 PP -16.927; 8.613; 14.335
83.295; 81.574; 80.251
830.1Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin
Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203
2312095 CIF
HKL
Paper
C18 H16 N3 O2 PP -16.267; 9.551; 14.615
88.185; 84.742; 75.841
844.6Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin
Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203
2312096 CIF
HKL
Paper
C18 H19 N2 O2 PC 1 2/c 127.998; 10.747; 11.362
90; 97.344; 90
3391Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin
Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203
2312097 CIF
HKL
C26 H21 Cl N6 OP -19.652; 9.7408; 14.1445
98.183; 104.638; 90.059
1272.6Vicentes, Daniel E.; Rodríguez, Ricaurte; Cobo, Justo; Glidewell, Christopher
Synthesis of 5-(arylmethylideneamino)-4-(1H-benzo[d]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of two intermediates and three final products.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 227-236
2312098 CIF
HKL
Paper
C24 H21 N OC 1 2/c 119.5522; 5.8693; 31.3714
90; 91.438; 90
3599Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E.
Crystal structures, Hirshfeld analysis, and energy framework analysis of two differently 3'-substituted 4-methylchalcones: 3'-(N=CHC<sub>6</sub>H<sub>4</sub>-p-CH<sub>3</sub>)-4-methylchalcone and 3'-(NHCOCH<sub>3</sub>)-4-methylchalcone.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 217-226
2312099 CIF
HKL
Paper
C18 H17 N O2C 1 2/c 125.1922; 5.7621; 20.7012
90; 109.066; 90
2840.14Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E.
Crystal structures, Hirshfeld analysis, and energy framework analysis of two differently 3'-substituted 4-methylchalcones: 3'-(N=CHC<sub>6</sub>H<sub>4</sub>-p-CH<sub>3</sub>)-4-methylchalcone and 3'-(NHCOCH<sub>3</sub>)-4-methylchalcone.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 217-226
2312100 CIF
HKL
Paper
C161 H210 Cl16 N4 Ni O20 P4 Pt2 Si4P -112.702; 19.372; 20.34
71.313; 81.809; 78.917
4635Gildenast, Hans; Gruszien, Lukas; Englert, Ulli
The heterometallic one-dimensional solvated coordination polymer [NiPt<sub>2</sub>Cl<sub>6</sub>(TRIP-Py)<sub>4</sub>]<sub>n</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 118-124
2312111 CIF
HKL
Paper
Nd0.51 Ni4.83 Tb1.51 Zn12.17R -3 m :H9.0637; 9.0637; 13.2319
90; 90; 120
941.38Nytka, Vitalii; Kordan, Vasyl; Stetskiv, Andrij; Pavlyuk, Volodymyr
Tb<sub>2-x</sub>Nd<sub>x</sub>Zn<sub>17-y</sub>Ni<sub>y</sub> (x = 0.5, y = 4.83): a new intermetallic with a maximum disordered structure and its hydrogen storage properties.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 257-262
2312112 CIF
HKL
Paper
C14 H8 F N O2 SP -17.5224; 8.4415; 10.82
91.437; 104.157; 112.754
608.8Çakmak, Şukriye; Aycan, Tuğba; Yakan, Hasan; Veyisoğlu, Aysel; Tanak, Hasan; Evecen, Meryem
Preparation, spectroscopic, X-ray crystallographic, DFT, antimicrobial and ADMET studies of N-[(4-flourophenyl)sulfanyl]phthalimide.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 249-256
2312125 CIF
HKL
Paper
C6 H32 Cl3 Co N6 O4P -3 c 111.3193; 11.3193; 15.4254
90; 90; 120
1711.6Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
2312126 CIF
HKL
Paper
C12 H60 Cl7 Co2 N12 Na O6P -3 c 111.354; 11.354; 15.683
90; 90; 120
1751Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
2312127 CIF
HKL
Paper
C12 H60 Cl7 Co2 K N12 O6P -3 c 111.4444; 11.4444; 15.649
90; 90; 120
1775.02Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
2312128 CIF
HKL
Paper
C12 H64 Cl7 Co2 N13 O6P -3 c 111.4131; 11.4131; 15.578
90; 90; 120
1757.3Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
2312129 CIF
HKL
Paper
C12 H60 Cl7 Co2 N12 Na O6P 311.32; 11.32; 8.049
90; 90; 120
893.2Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
2312130 CIF
HKL
Paper
C13 H20 N6 SP 1 21/n 19.1032; 10.9034; 15.3748
90; 107.202; 90
1457.78Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata
Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291
2312131 CIF
HKL
Paper
C14 H22 N6 SP 1 21/c 19.3148; 9.386; 36.2261
90; 94.812; 90
3156.04Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata
Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291
2312132 CIF
HKL
Paper
C15 H19 N5 O2 SI 1 a 17.96887; 10.94707; 18.4759
90; 96.242; 90
1602.2Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata
Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291
2312133 CIF
HKL
Paper
C20 H16 N4 O6 PbP 1 21/n 17.769; 22.149; 13.656
90; 99.399; 90
2318Liu, Xiangning; Cai, Hua; Zhou, Ruikang; Li, Yaqi
Construction of a Pb<sup>II</sup> coordination polymer from a semi-rigid ditopic 2,2-biimidazole derivative: synthesis, crystal structure and characterization.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 263-268
2312134 CIF
HKL
Paper
C17 H24 N2 O5P 21 21 214.82; 19.11; 19.28
90; 90; 90
1775.9Gessmann, Renate; Garcia-Saez, Isabel; Simatos, Georgios; Mitraki, Anna
Z-Ala-Ile-OH, a dipeptide building block suitable for the formation of orthorhombic microtubes.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 277-282
2312135 CIF
Paper
C6 H12 B N O7 SP b c a14.1807; 7.4675; 20.0702
90; 90; 90
2125.32Rivera-Segura, Jacobo; Barba, Victor; Hernandez-Ahuactzi, Iran F; Tlahuext, Hugo
Boron-π interactions in two 3-(dihydroxyboryl)anilinium salts analyzed by crystallographic studies and supported by the noncovalent interactions (NCI) index theoretical approach.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 269-276
2312136 CIF
HKL
Paper
C7 H12 B N O6 SP 1 21/n 110.97561; 7.22452; 13.5494
90; 103.343; 90
1045.38Rivera-Segura, Jacobo; Barba, Victor; Hernandez-Ahuactzi, Iran F; Tlahuext, Hugo
Boron-π interactions in two 3-(dihydroxyboryl)anilinium salts analyzed by crystallographic studies and supported by the noncovalent interactions (NCI) index theoretical approach.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 269-276
2312145 CIF
HKL
Paper
C34 H78 Cd N4 O6 S2 Si2P 1 21/n 116.424; 16.876; 18.265
90; 112.66; 90
4672Kowalkowska-Zedler, Daria; Bruździak, Piotr; Hnatejko, Zbigniew; Łyszczek, Renata; Brillowska-Dąbrowska, Anna; Ponikiewski, Łukasz; Cieśla, Bartosz; Pladzyk, Agnieszka
Solvent influence on the crystal structures of new cadmium tri-tert-butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity.
Acta crystallographica. Section C, Structural chemistry, 2023
2312146 CIF
HKL
Paper
C58 H132 Cd2 N4 O12 S4 Si4P 1 21/n 19.6433; 29.0546; 14.5665
90; 91.466; 90
4079.94Kowalkowska-Zedler, Daria; Bruździak, Piotr; Hnatejko, Zbigniew; Łyszczek, Renata; Brillowska-Dąbrowska, Anna; Ponikiewski, Łukasz; Cieśla, Bartosz; Pladzyk, Agnieszka
Solvent influence on the crystal structures of new cadmium tri-tert-butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity.
Acta crystallographica. Section C, Structural chemistry, 2023
2312147 CIF
HKL
Paper
C14 H13 N3 O5P 1 21/n 115.3082; 5.202; 18.6832
90; 112.809; 90
1371.46Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer
New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248
2312148 CIF
HKL
Paper
C22 H17 Cl N2 O4P 1 21/n 15.1567; 21.1373; 17.8054
90; 92.826; 90
1938.41Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer
New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248
2312149 CIF
HKL
Paper
C24 H20 N2 O3P 1 21/c 115.344; 5.4552; 23.7301
90; 96.148; 90
1974.89Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer
New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248
2312150 CIF
HKL
Paper
C21 H18 N4 O2P 1 21/n 15.1236; 17.7396; 19.7236
90; 91.09; 90
1792.37Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer
New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248
2312153 CIF
HKL
Paper
C28 H20 Cl N4 P TeP 1 21/n 118.2538; 7.3008; 20.0497
90; 106.867; 90
2557.02Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L.
<sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523
2312154 CIF
HKL
Paper
C12 H20 Cl N4 P TeP -16.95; 9.5921; 13.604
102.427; 101.89; 91.876
863.8Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L.
<sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523
2312155 CIF
HKL
Paper
C14 H6 N8 O2 Se2P 1 21/c 16.2634; 7.4089; 18.32
90; 96.42; 90
844.8Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L.
<sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals.
Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523
2312156 CIF
HKL
Paper
C26 H28 N4 O10 ZrP 1 2/n 111.3873; 9.0517; 14.4136
90; 113.225; 90
1365.28Harmošová, Michaela; Vilková, Mária; Kello, Martin; Smolko, Lukáš; Samol'ová, Erika; Šebová, Dominika; Potočňák, Ivan
Low-dimensional compounds containing bioactive ligands. XXII. First crystal structure, cytotoxic activity and DNA and HSA binding of a zirconium(IV) complex with 8-hydroxyquinoline-2-carboxylic acid.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312157 CIF
HKL
Paper
C19 H17 N O2P -17.774; 7.9955; 12.4836
106.383; 98.191; 93.279
732.96Yahiaoui, Ahmed Abderrahim; Ghichi, Nadir; Hannachi, Douniazed; Mezhoud, Bilel; Djedouani, Amel; Kraim, Khairedine; Crochet, Aurélien; Stoeckli-Evans, Helen
The synthesis and crystal structure of (E)-2-{[(4-methoxynaphthalen-1-yl)methylidene]amino}-4-methylphenol: Hirshfeld surface analysis, DFT calculations and anticorrosion studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312275 CIF
HKL
Paper
Cd Cu2 S4 SiP m n 217.60853; 6.48071; 6.24923
90; 90; 90
308.141Treece, Megan M.; Kelly, Jordan C.; Rosello, Kate E.; Craig, Andrew J.; Aitken, Jennifer A.
Accurate X-ray diffraction data required for proper evaluation of bond valence sums and global instability indexes: redetermination of the crystal structures of diamond-like Cu<sub>2</sub>CdSiS<sub>4</sub> and Cu<sub>2</sub>HgSnS<sub>4</sub> as a case study.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312276 CIF
HKL
Paper
Cu2 Hg S4 SnI -4 2 m5.5798; 5.5798; 10.86
90; 90; 90
338.12Treece, Megan M.; Kelly, Jordan C.; Rosello, Kate E.; Craig, Andrew J.; Aitken, Jennifer A.
Accurate X-ray diffraction data required for proper evaluation of bond valence sums and global instability indexes: redetermination of the crystal structures of diamond-like Cu<sub>2</sub>CdSiS<sub>4</sub> and Cu<sub>2</sub>HgSnS<sub>4</sub> as a case study.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312277 CIF
HKL
Paper
C21 H21 N3 O3P 1 21/n 17.4355; 34.195; 7.7242
90; 112.512; 90
1814.3Scheepers, Matthew Clarke; Lemmerer, Andreas
The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312278 CIF
HKL
Paper
C17 H19 N3 O5P 1 21/n 111.0834; 13.8364; 12.0014
90; 115.71; 90
1658.26Scheepers, Matthew Clarke; Lemmerer, Andreas
The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312279 CIF
HKL
Paper
C20 H19 N3 O3C 1 c 17.6312; 33.5293; 7.3493
90; 114.298; 90
1713.88Scheepers, Matthew Clarke; Lemmerer, Andreas
The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312280 CIF
HKL
Paper
C17 H17 Cl N4 O5P 1 21/n 17.2682; 34.0775; 7.6124
90; 111.081; 90
1759.27Scheepers, Matthew Clarke; Lemmerer, Andreas
The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312281 CIF
HKL
Paper
C17 H19 N3 O5P -19.2054; 11.5589; 15.6268
92.383; 93.092; 90.666
1658.74Scheepers, Matthew Clarke; Lemmerer, Andreas
The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312282 CIF
HKL
Paper
C8 H6 N4 S2P -15.6832; 7.4639; 11.7473
91.524; 95.245; 106.024
476.24Wzgarda-Raj, Kinga; Dominikowska, Justyna; Husik, Natallia; Rybarczyk-Pirek, Agnieszka J
2,2'-Dithiobispyrazine: about the disulfide bond.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312301 CIF
HKL
Paper
C15 H17 N O4P 1 21/c 111.7637; 11.746; 10.3316
90; 111.384; 90
1329.31Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe
A structural comparison of salt forms of dopamine with the structures of other phenylethylamines.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312302 CIF
HKL
Paper
C15 H16 N2 O6P 1 21/n 17.4993; 18.5051; 10.761
90; 99.628; 90
1472.33Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe
A structural comparison of salt forms of dopamine with the structures of other phenylethylamines.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312303 CIF
HKL
Paper
C18 H28 N2 O10 S2P b c a10.6328; 8.5651; 23.8669
90; 90; 90
2173.6Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe
A structural comparison of salt forms of dopamine with the structures of other phenylethylamines.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312304 CIF
HKL
Paper
C14 H19 N O7 SP 1 21/c 117.4085; 11.9234; 7.6779
90; 95.273; 90
1586.95Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe
A structural comparison of salt forms of dopamine with the structures of other phenylethylamines.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312305 CIF
HKL
Paper
C6 H12 Bi O9P -17.6518; 8.2376; 9.6402
102.414; 93.1; 115.838
526.51Timakova, Evgeniya V.; Afonina, Liubov I.; Drebushchak, Tatiana N.; Zakharov, Boris A.
Two new bismuth salts with succinic acid: synthesis, structural, spectroscopic and thermal characterization.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312306 CIF
HKL
Paper
C8 H14 Bi2 O12P -17.8258; 9.6629; 10.1924
81.457; 75.553; 77.881
725.97Timakova, Evgeniya V.; Afonina, Liubov I.; Drebushchak, Tatiana N.; Zakharov, Boris A.
Two new bismuth salts with succinic acid: synthesis, structural, spectroscopic and thermal characterization.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312307 CIF
HKL
Paper
C81 H58 Cl2 O38 P2C 1 2/c 128.778; 16.511; 34.938
90; 108.189; 90
15771Som, Shubham; Hasija, Avantika; Chopra, Deepak
From liquid to crystal via mechanochemical grinding: unique host-guest (HOF) cocrystal.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312308 CIF
HKL
Paper
C16 H12 N2 O10 Tc2P n a 2118.116; 10.359; 12.148
90; 90; 90
2280Zuhayra, Maaz; Lützen, Arne; Ruiz, Miguel A.
X-ray-determined structure of the technetium complex [Tc<sub>2</sub>(μ-CO)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] revisited: [Tc<sub>2</sub>(μ-OMe)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] as the correct formulation.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312309 CIF
HKL
Paper
C18 H16 N2 O8 Tc2P n a 2118.116; 10.359; 12.148
90; 90; 90
2280Zuhayra, Maaz; Lützen, Arne; Ruiz, Miguel A.
X-ray-determined structure of the technetium complex [Tc<sub>2</sub>(μ-CO)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] revisited: [Tc<sub>2</sub>(μ-OMe)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] as the correct formulation.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312310 CIF
HKL
Paper
C10 H15 Cl N6 O4P -18.3769; 8.7294; 9.7804
74.8391; 79.5481; 78.3934
669.88Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J.
Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312311 CIF
HKL
Paper
C11 H16 N6 O6P 1 21/c 18.2567; 12.7736; 13.2612
90; 102.433; 90
1365.8Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J.
Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312312 CIF
HKL
Paper
C4 H11 N5 O5 SP 1 21/n 19.0198; 10.1953; 9.8987
90; 103.305; 90
885.85Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J.
Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312313 CIF
HKL
Paper
C11 H15 N7 O8P -16.977; 10.5805; 11.217
83.491; 87.651; 80.623
811.5Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J.
Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312314 CIF
HKL
Paper
C34 H22 N4P -18.5339; 11.8471; 13.2628
87.563; 71.508; 85.627
1267.72Chen, Ziqiang; Xin, Gaojie; Gao, Penglian; Jin, Yingying
Synthesis, structures and properties of two donor-acceptor acridone-based compounds.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312315 CIF
HKL
Paper
C34 H20 N4P 1 21/c 111.7306; 7.1509; 29.769
90; 96.28; 90
2482.2Chen, Ziqiang; Xin, Gaojie; Gao, Penglian; Jin, Yingying
Synthesis, structures and properties of two donor-acceptor acridone-based compounds.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312316 CIF
HKL
Paper
C44 H52 Cu2 K2 O4P -19.6864; 10.484; 10.658
66.22; 89.67; 82.73
981.3Young, Jr, Victor G; Brennessel, William W.; Ellis, John E.
Crystal structure and synthesis of the bis(anthracene)dicuprate dianion as the dipotassium salt, [K(tetrahydrofuran)<sub>2</sub>]<sub>2</sub>[{Cu(9,10-η<sup>2</sup>-anthracene)}<sub>2</sub>], the first anionic arene complex of copper.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 456-463
2312321 CIF
HKL
Paper
C13 H12 F3 N3 O SP 1 21/c 17.2418; 28.0107; 7.3569
90; 116.29; 90
1337.97Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Gzella, Andrzej K.; Jaskolski, Mariusz
Proton tautomerism and stereoisomerism in 5-[(dimethylamino)methylidene]-4-[3/4-(trifluoromethylphenyl)amino]-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312322 CIF
HKL
Paper
C13 H12 F3 N3 O SP 1 21/c 16.1727; 27.9473; 7.6297
90; 90.123; 90
1316.2Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Gzella, Andrzej K.; Jaskolski, Mariusz
Proton tautomerism and stereoisomerism in 5-[(dimethylamino)methylidene]-4-[3/4-(trifluoromethylphenyl)amino]-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312323 CIF
HKL
Paper
C16 H16 Br N3P -17.8073; 9.8003; 10.79
72.964; 85.084; 74.448
760.44Moreno-Suárez, Erika; Avila-Acosta, Rafael; Sánchez-Ramírez, Karen; Castillo, Juan Carlos; Macías, Mario A
Crystallographic, spectroscopic and thermal studies of 1-(4-bromophenyl)-5-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1H-pyrazole.
Acta crystallographica. Section C, Structural chemistry, 2023, 79
2312333 CIF
HKL
Paper
C32 H28 Cl6 N8 RuP -111.2435; 11.4038; 13.634
74.278; 75.995; 84.642
1631.99Faller, Jack; Chase, Kevin J.; Parr, Jonathan; Mercado, Brandon
Studies of κ<sup>2</sup>- and κ<sup>3</sup>-tripyridylamine complexes of ruthenium and π-stacking by pyridyls.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 491-496
2312334 CIF
HKL
Paper
C31 H25 Cl4 F6 N8 Ru SbP 1 21/n 18.3209; 27.3213; 15.7839
90; 99.554; 90
3538.5Faller, Jack; Chase, Kevin J.; Parr, Jonathan; Mercado, Brandon
Studies of κ<sup>2</sup>- and κ<sup>3</sup>-tripyridylamine complexes of ruthenium and π-stacking by pyridyls.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 491-496
2312347 CIF
HKL
Paper
C30 H26 Cl3 N O4P 1 21 110.0732; 10.0051; 14.7474
90; 109.945; 90
1397.15Czapik, Agnieszka; Kwit, Marcin
Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756
2312348 CIF
HKL
Paper
C30 H27 Cl2 N O4P 1 21 110.04475; 9.82563; 14.59465
90; 108.742; 90
1364.05Czapik, Agnieszka; Kwit, Marcin
Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756
2312349 CIF
HKL
Paper
C30 H26 Cl3 N O4P 21 21 29.27898; 32.3574; 9.96336
90; 90; 90
2991.44Czapik, Agnieszka; Kwit, Marcin
Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756
2312350 CIF
HKL
Paper
C29.1 H25.2 Cl0.2 N O4P 21 21 219.28862; 10.34013; 24.3525
90; 90; 90
2338.95Czapik, Agnieszka; Kwit, Marcin
Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756
2312351 CIF
HKL
Paper
C30.5 H26.5 Cl4.5 N O4P 1 21/c 110.00099; 9.33129; 31.8959
90; 90.4958; 90
2976.48Czapik, Agnieszka; Kwit, Marcin
Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756
2312363 CIF
HKL
Paper
C10 H16 Cl2 Co0.2 N4 Zn0.8C 1 2/c 115.0191; 8.304; 23.9862
90; 95.8239; 90
2976.08Adach, Anna; Tyszka-Czochara, Małgorzata; Daszkiewicz, Marek
An efficient one-pot synthesis of pyrazole complexes formed in situ: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 520-529
2312364 CIF
HKL
Paper
C20 H30 Br1.4 Cl0.6 Co0.2 N8 Zn1.8P -18.2698; 8.406; 10.3062
84.826; 69.156; 87.133
666.7Adach, Anna; Tyszka-Czochara, Małgorzata; Daszkiewicz, Marek
An efficient one-pot synthesis of pyrazole complexes formed in situ: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 520-529
2312365 CIF
HKL
Paper
C14 H14 N2 O6 UP 1 21/n 17.734; 19.01; 10.6154
90; 96.106; 90
1551.9Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M.
Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312366 CIF
HKL
Paper
C34 H36 N6 O15 U3P 1 21/n 113.809; 12.6324; 23.699
90; 103.412; 90
4021.3Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M.
Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312367 CIF
HKL
Paper
C24 H22 N4 O6 UP -18.006; 8.786; 8.833
78.274; 84.648; 74.814
586.6Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M.
Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312385 CIF
HKL
Paper
C10 H13 N5 O3P 15.2027; 8.9738; 12.3715
78.249; 83.171; 76.338
547.97Leonard, Peter; Zhang, Aigui; Budow-Busse, Simone; Daniliuc, Constantin; Seela, Frank
α-D-2'-Deoxyadenosine, an irradiation product of canonical DNA and a component of anomeric nucleic acids: crystal structure, packing and Hirshfeld surface analysis.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 21-29
2312393 CIF
HKL
Paper
C41 H47 Br F N7 O7 SP -112.5755; 12.6649; 14.4336
68.909; 82.733; 75.557
2075.3Yang, Haiwu; Liang, Minyi; Tian, Fang
Crystal structure and Hirshfeld surface analysis of a salt of antineoplastic kinase inhibitor vandetanib.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312394 CIF
HKL
Paper
C22 H32.64 Ag N9 O13.32 S2C 2 2 214.8791; 22.049; 28.256
90; 90; 90
3039.8Al-Mahamad, Lamia L G; Clegg, William
Synthesis and crystal structure of a silver(I) 6-methylmercaptopurine riboside complex.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312395 CIF
HKL
Paper
C52 H40 F4 N4 PtI 4/m17.1883; 17.1883; 9.1123
90; 90; 90
2692.1Dash, Zane S.; Huang, Raymond Q.; Kimber, Ana N.; Olubajo, Opeyemi T.; Polk, Mark; Rancu, Oliver P.; Zhang, Lauren L.; Fu, Jane; Nagelj, Nejc; Reynolds, Kristopher G.; Zheng, Shao Liang; Dogutan, Dilek K.
Oxygen quenching of structurally characterized [5,10,15,20-tetrakis(4-fluoro-2,6-dimethylphenyl)porphyrinato]platinum(II).
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312396 CIF
Paper
C27 H41 N3 O5I 1 2 140.2744; 5.0976; 27.698
90; 105.729; 90
5473.5Gurung, Kshitij; Šimek, Petr; Jegorov, Jr, Alexandr; Palatinus, Lukáš
Structure and absolute configuration of natural fungal product beauveriolide I, isolated from Cordyceps javanica, determined by 3D electron diffraction.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 56-61
2312397 CIF
Paper
C58 H52 N4 O8P 21 21 2133.5486; 26.4223; 5.36515
90; 90; 90
4755.84Guerain, Mathieu; Correia, Natalia T.; Roca-Paixão, Luisa; Chevreau, Hubert; Affouard, Frederic
Using synchrotron high-resolution powder X-ray diffraction for the structure determination of a new cocrystal formed by two active principle ingredients.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 37-42
2312416 CIF
Paper
C36 H42 Cl2 N2 O3C 1 2/c 113.8926; 11.9663; 19.3872
90; 100.384; 90
3170.2Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A.
Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 91-97
2312417 CIF
Paper
C6 H12 O6P 1 21/n 16.61708; 12.0474; 18.88721
90; 93.9791; 90
1502.03Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A.
Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 91-97
2312418 CIF
HKL
Paper
C29 H21 Br N4 O5 ZnP 1 21/c 19.73; 16.52; 17.649
90; 103.19; 90
2762Wang, Yan; Cheng, Wei Wei; Mou, Yi; Wen, Shuai; Wang, Dongkai; Xue, Yun Shan
A twofold interpenetrated two-dimensional zinc(II) coordination polymer for the highly sensitive detection of nitrofurantoin in aqueous medium.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312419 CIF
HKL
Paper
C20 H20 N6 OP -19.455; 9.628; 12.023
69.506; 79.904; 66.215
937.4Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312420 CIF
HKL
Paper
C17 H12 N6P b c a8.5626; 18.701; 19.024
90; 90; 90
3046.3Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312421 CIF
HKL
Paper
C17 H11 Br N6P -18.551; 9.4214; 11.5813
85.894; 70.776; 65.64
800.3Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312422 CIF
HKL
Paper
C17 H11 Cl N6P -18.5105; 9.3681; 10.8959
81.355; 82.482; 67.388
790.3Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312423 CIF
HKL
Paper
C17 H11 F N6P -18.624; 9.503; 10.471
80.312; 81.512; 64.78
762.5Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312424 CIF
HKL
Paper
C18 H14 N6P b c a15.7069; 11.8266; 17.5763
90; 90; 90
3265Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru
Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312429 CIF
HKL
Paper
C20 H14 N2 O4P -17.6186; 9.4985; 11.9173
105.38; 95.005; 93.78
824.78Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas
Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312430 CIF
HKL
Paper
C13 H13 N3 O4P 1 21 18.2555; 6.752; 11.8096
90; 90.573; 90
658.25Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas
Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312458 CIF
HKL
Paper
C22 H22 N2 O2P 1 21/c 112.8456; 5.5803; 16.7446
90; 132.566; 90
884.01Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya
Three polymorphs of a new N,N'-dipropylated isoindigo derivative.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312459 CIF
HKL
Paper
C22 H22 N2 O2C 1 2/c 135.4947; 5.5238; 18.9927
90; 109.151; 90
3517.73Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya
Three polymorphs of a new N,N'-dipropylated isoindigo derivative.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312460 CIF
HKL
Paper
C22 H22 N2 O2P 1 21/c 115.0486; 9.1347; 18.5227
90; 136.112; 90
1765.16Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya
Three polymorphs of a new N,N'-dipropylated isoindigo derivative.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312461 CIF
Paper
C12 H13 N3 O4 SP 1 21 15.8163; 6.9218; 15.6295
90; 93.354; 90
628.154Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312462 CIF
Paper
C12 H17 N3 O7 SP -18.2876; 10.6404; 17.4834
89.734; 84.793; 86.146
1531.91Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312463 CIF
Paper
C12 H17 N4 O4.5 SC 1 2/c 135.1636; 7.8905; 10.4972
90; 100.091; 90
2867.5Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312464 CIF
Paper
C16 H24 N4 O6 SP -18.4933; 13.0977; 17.1657
90.97; 103.18; 95.132
1850.43Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312465 CIF
Paper
C12 H13 N3 O4 SP c c n12.6592; 28.3597; 7.1268
90; 90; 90
2558.6Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312466 CIF
Paper
C12 H11 K N2 O5 SP -15.962; 7.2033; 31.929
83.852; 86.361; 88.868
1360.5Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312467 CIF
Paper
C12 H14 K N3 O5 SP -113.3058; 13.6247; 18.4664
88.373; 73.971; 66.313
2933.52Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312468 CIF
Paper
C16 H22 K N3 O7 SP 1 21/n 19.4006; 12.1583; 34.4743
90; 95.496; 90
3922.14Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312469 CIF
Paper
C12 H9 K N2 O4 SP c c n12.5535; 27.9698; 6.9982
90; 90; 90
2457.2Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier
Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79
2312470 CIF
Paper
C13 H14 O5P 21 21 214.9524; 11.0302; 20.9007
90; 90; 90
1141.72Decato, Daniel; Palatinus, Lukáš; Stierle, Andrea; Stierle, Donald
Absolute structure determination of Berkecoumarin by X-ray and electron diffraction.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312471 CIF
HKL
Paper
C44 H48 Cl6 Fe3 N16 OP -18.9568; 12.8555; 12.8951
116.349; 91.178; 91.622
1329.09Pacholski, Roman; Durka, Krzysztof; Buchalski, Piotr
Synthesis and crystal structure of an iron triazole complex resulting from the unexpected ligand cleavage of a triazolium carbene precursor.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312472 CIF
Paper
C68 H56 B3 Ce Cl4 N12 O6P 1 21/c 111.2742; 27.1355; 21.3644
90; 90.166; 90
6536Thomas, Jarrod R.; Sulway, Scott A.
Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312473 CIF
Paper
C67 H54 B3 Cl2 Dy N12 O6P -112.1461; 16.1883; 17.1795
102.659; 103.322; 95.948
3164.6Thomas, Jarrod R.; Sulway, Scott A.
Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312474 CIF
Paper
C66 H52 B3 Dy N12 O6P -111.72; 11.9389; 21.9139
75.579; 76.715; 86.477
2890.2Thomas, Jarrod R.; Sulway, Scott A.
Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312475 CIF
HKL
Paper
Ge29.7 Mg22.3 Ni64F m -3 m11.5036; 11.5036; 11.5036
90; 90; 90
1522.3Pavlyuk, Nazar; Dmytriv, Grygoriy; Bondaruk, Alina; Ciesielski, Wojciech; Pavlyuk, Volodymyr
Crystal, electronic structure and hydrogenation properties of the Mg<sub>5.57</sub>Ni<sub>16</sub>Ge<sub>7.43</sub> cluster phase with a new type of polyhedron.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312476 CIF
HKL
Paper
C6 H10 N8 O12P b c a21.4196; 6.1927; 21.9265
90; 90; 90
2908.44Domasevitch, Kostiantyn V.; Krautscheid, Harald
Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312477 CIF
HKL
Paper
C6 H12 N8 O13P 1 21/c 111.2164; 20.8114; 6.6646
90; 90.435; 90
1555.67Domasevitch, Kostiantyn V.; Krautscheid, Harald
Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312478 CIF
Paper
C10 H16 Cu4 N6 O2C 1 2/c 19.6829; 8.2557; 21.4992
90; 95.212; 90
1711.52Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher
Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312479 CIF
Paper
C10 H18 Cu3 N6 O2P 1 21/c 19.3903; 8.9608; 9.7986
90; 112.134; 90
763.74Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher
Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312480 CIF
Paper
C8 H14 Cu3 N6 O2P 1 21/c 19.5158; 8.8022; 9.3589
90; 117.358; 90
696.22Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher
Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312483 CIF
Paper
C12 H16 N2 O4P 41 21 211.1312; 11.1312; 10.894
90; 90; 90
1349.8González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector
Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312484 CIF
Paper
C19 H24 N6 O6P -17.5284; 11.2362; 12.2606
85.742; 76.887; 79.803
993.5González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector
Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312485 CIF
Paper
C14 H18 N4 O9P -114.6803; 8.8743; 6.9537
106.922; 96.304; 97.55
848.64Guerain, Mathieu; Chevreau, Hubert; Guinet, Yannick; Paccou, Laurent; Elkaïm, Erik; Hédoux, Alain
Relationship between synthesis method-crystal structure-melting properties in cocrystals: the case of caffeine-citric acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312503 CIF
HKL
Paper
C44 H34 Cl2 Mn N6 O10P -18.93282; 12.32698; 18.86081
89.8757; 85.6122; 83.5667
2057.68Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto
Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312504 CIF
HKL
Paper
C42 H30 Cl2 Mn N6 O8P 1 21/c 19.51026; 12.5149; 31.2962
90; 96.878; 90
3698.07Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto
Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312505 CIF
HKL
Paper
C42 H30 Cl2 N6 Ni O8P 1 21/c 19.3581; 12.6255; 31.4046
90; 97.038; 90
3682.52Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto
Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312506 CIF
HKL
Paper
C18 H24 Ca O20 ZnC 1 2/c 117.848; 20.106; 6.5975
90; 97.997; 90
2344.5Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong
Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312507 CIF
HKL
Paper
C18 H24 Ca Co O20C 1 2/c 117.875; 20.192; 6.5339
90; 98.557; 90
2332Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong
Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312508 CIF
HKL
Paper
C18 H30 Ca O24 Zn2C c c a :26.9927; 18.934; 20.808
90; 90; 90
2755Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong
Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312509 CIF
Paper
C52 H68 Cu2 O24P c c n27.7701; 21.2278; 9.3888
90; 90; 90
5534.7Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312510 CIF
Paper
C45 H61 Cu2 N O18P -110.1659; 10.7383; 12.9878
76.132; 69.646; 75.304
1267.74Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312511 CIF
Paper
C40 H49 Cu2 Li O24P -19.7711; 10.1924; 12.5863
73.615; 79.528; 83.412
1179.87Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312512 CIF
Paper
C43 H56 Cu2 N4 O15P -18.886; 10.702; 12.36
73.13; 73.07; 81.68
1073.8Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312513 CIF
Paper
C85 H108 Cu4 N2 O32P n m a12.833; 54.548; 12.119
90; 90; 90
8483Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312514 CIF
Paper
C44 H64 Cu2 N4 O20P -110.4964; 10.6595; 12.3226
97.271; 101.042; 108.13
1260.15Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312515 CIF
Paper
C68 H84 Cu2 N4 O21P -110.2155; 12.0897; 15.7111
69.581; 75.988; 79.651
1754.64Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312516 CIF
Paper
C38 H30 Cu2 N2 O15C 1 2/c 111.9851; 17.7472; 17.1294
90; 92.637; 90
3639.6Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312517 CIF
Paper
C56 H52 Cu2 N4 O20P b c a17.5993; 16.4583; 19.7389
90; 90; 90
5717.46Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312518 CIF
Paper
C41 H54 Cu2 O20I 1 2/a 119.4801; 13.0774; 34.5443
90; 97.702; 90
8720.7Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312519 CIF
Paper
C70 H120 Cu2 N4 O30P 1 c 19.7404; 20.3001; 22.9088
90; 118.494; 90
3981.1Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312520 CIF
Paper
C13 H18 N2 O3P 1 21/n 115.3994; 10.6592; 16.9261
90; 110.424; 90
2603.68Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312521 CIF
Paper
C4 H4 F6 O6 S2P -110.036; 10.664; 11.276
83.54; 64.178; 89.593
1078.2Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander
Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 278-283
2312522 CIF
Paper
C3 H2 F6 O6 S2P 1 21 18.9822; 4.9413; 10.94
90; 102.406; 90
474.22Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander
Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 278-283
2312523 CIF
HKL
Paper
C16 H31 Li N2P -16.316; 9.6925; 13.7463
97.336; 99.662; 93.52
819.83Erickson, Alexander N.; Haltiwanger, Curtis; Rahim, Masoumeh; Garner, Charles M.
Preferential crystallization of (±)-pinenyllithium·TMEDA.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 297-301
2312524 CIF
Paper
C3 H8 N2 O4P b c a9.9714; 9.8671; 11.1884
90; 90; 90
1100.81Hollenwäger, Dirk; Nitzer, Alexander; Bockmair, Valentin; Kornath, Andreas J.
The crystal structure of the ammonium salt of 2-aminomalonic acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 291-296
2312525 CIF
HKL
Paper
C16 H24 N4 O6P -16.8383; 7.2272; 9.7427
82.921; 76.809; 82.043
462.18Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas
Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 302-310
2312526 CIF
HKL
Paper
C13 H13 Cl N2 O3P 1 21/c 111.7399; 8.3731; 13.6779
90; 106.782; 90
1287.27Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas
Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 302-310
2312527 CIF
HKL
Paper
C49 H39 F6 N2 O P3 RuP 1 21/n 110.5442; 21.1741; 21.9326
90; 97.528; 90
4854.6Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew
Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 319-330
2312528 CIF
HKL
Paper
C51 H43 F6 N2 O P3 RuP -111.7657; 14.1033; 14.9728
94.141; 97.381; 111.957
2265.6Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew
Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 319-330
2312529 CIF
HKL
Paper
C51 H43 F6 N2 O P3 RuP 1 21/c 114.9624; 21.9572; 17.1148
90; 109.266; 90
5307.9Wysocki, Waldemar; Kamecka, Anna; Karczmarzyk, Zbigniew
Synthesis and structural characterizations of three carbonyl(α-diimine)hydrido(triphenylphosphine)ruthenium(II) complexes with derivatives of 1,10-phenanthroline.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 319-330
2312530 CIF
Paper
C12 H26 I14 N2 Pd2 S4C 1 2/c 121.609; 8.198; 24.151
90; 100.17; 90
4211.1Blake, Alexander J.; Castellano, Carlo; Lippolis, Vito; Podda, Enrico; Schröder, Martin
Formation of extended polyiodides at large cation templates.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 311-318
2312531 CIF
Paper
C19 H40 Cl2 I9 N2 O6P 1 21/n 113.831; 14.82; 20.266
90; 96.7; 90
4125.7Blake, Alexander J.; Castellano, Carlo; Lippolis, Vito; Podda, Enrico; Schröder, Martin
Formation of extended polyiodides at large cation templates.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 311-318
2312532 CIF
HKL
Paper
C18 H34 N2 O12P 1 21 14.7599; 14.3223; 16.6515
90; 90.022; 90
1135.18Shit, Pradip; Tetrault, Timothy; Zhang, Wenhui; Yoon, Mi Kyung; Oliver, Allen G.; Serianni, Anthony S.
Conformational disorder in the crystal structure of methyl 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranoside (methyl β-chitobioside) methanol monosolvate.
Acta crystallographica. Section C, Structural chemistry, 2024, 80, 331-336
2312536 CIF
Paper
C26 H22 Mn O2 P SP 1 21/c 17.7281; 16.8523; 18.0339
90; 96.696; 90
2332.65Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz
Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>].
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312537 CIF
Paper
C27 H23 Br Mn O2 P S2P b c a16.5563; 16.2392; 19.3372
90; 90; 90
5199Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz
Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>].
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312538 CIF
Paper
C28 H25 Br Mn O2 P S3P 1 21/n 18.7717; 13.2135; 23.9428
90; 92.884; 90
2771.6Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz
Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>].
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312539 CIF
Paper
C30 H30 Mn O2 P S5P 1 21/c 112.5274; 13.6748; 17.9841
90; 107.934; 90
2931.2Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz
Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>].
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312540 CIF
Paper
C56.5 H51 Br2 Mn2 O4 P2 S2P -110.3309; 10.7727; 13.0821
87.692; 82.138; 62.507
1278.93Klein-Hessling, Christian; Blockhaus, Tobias; Sünkel, Karlheinz
Synthesis, spectroscopic and crystallographic characterization of various cymantrenyl thioethers [Mn{C<sub>5</sub>H<sub>x</sub>Br<sub>y</sub>(SMe)<sub>z</sub>}(PPh<sub>3</sub>)(CO)<sub>2</sub>].
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312541 CIF
HKL
Paper
C25 H21 Cl N2 O4 SP b c a10.792; 18.713; 23.299
90; 90; 90
4705.25Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing
Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312542 CIF
HKL
Paper
C25 H20 Cl F N2 O4 SP b c a10.536; 19.246; 23.343
90; 90; 90
4733.4Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing
Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312543 CIF
HKL
Paper
C25 H20 Cl N3 O6 SP -17.489; 8.302; 21.384
93.03; 91.61; 111.17
1236.5Ma, Yu Heng; Yang, Kang; Qian, Yan Ling; Hong, Wei Pu; Zhang, Kai Yue; Tao, Zhen Wei; Meng, Hui; Ma, Wen Jing
Supramolecular interactions in cocrystals of benzoic acid derivatives with selective COX-2 inhibitor etoricoxib.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312544 CIF
Paper
C14 H12 F2 N2 O2P -13.8047; 11.0101; 15.4968
79.535; 89.223; 82.88
633.42Sánchez-Pacheco, Addi Dana; Huerta, Eduardo H.; Espinosa-Camargo, Josué Benjamín; Rodríguez-Nájera, Evelyn Valeria; Martínez-Otero, Diego; Hernández-Ortega, Simón; Valdés-Martínez, Jesús
Using cocrystals as a tool to study non-crystallizing molecules: crystal structure, Hirshfeld surface analysis and computational study of the 1:1 cocrystal of (E)-N-(3,4-difluorophenyl)-1-(pyridin-4-yl)methanimine and acetic acid.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312545 CIF
Paper
C12 H9 N O5P 1 21/c 113.0541; 13.4304; 13.1257
90; 115.354; 90
2079.57Palme, Paul R.; Goddard, Richard; Richter, Adrian; Imming, Peter; Seidel, Rüdiger W
3-[(Benzo-1,3-dioxol-5-yl)amino]-4-methoxycyclobut-3-ene-1,2-dione: polymorphism and twinning of a precursor to an antimycobacterial squaramide.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312546 CIF
Paper
C12 H9 N O5P -13.7001; 12.4583; 22.846
89.55; 86.967; 81.46
1040Palme, Paul R.; Goddard, Richard; Richter, Adrian; Imming, Peter; Seidel, Rüdiger W
3-[(Benzo-1,3-dioxol-5-yl)amino]-4-methoxycyclobut-3-ene-1,2-dione: polymorphism and twinning of a precursor to an antimycobacterial squaramide.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312547 CIF
HKL
Paper
C66 H106 Er N5 O17.5 S3P 1 21/n 115.3967; 30.6741; 16.0612
90; 90.172; 90
7585.35Araujo Junior, Cleber R.; Oliveira, Willian X. C.; Pinheiro, Carlos B.; Pedroso, Emerson F.; Nunes, Wallace C.; Almeida, Adriele A de; Knobel, Marcelo; Julve, Miguel; Pereira, Cynthia L. M.
Crystal structure and cryomagnetic study of a mononuclear erbium(III) oxamate inclusion complex.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
2312548 CIF
HKL
Paper
C27 H22 Br2 Co N3 O2 S3P c a 2116.5337; 13.2578; 13.4575
90; 90; 90
2949.9Mandal, Uttam; Rizzoli, Corrado; Chakraborty, Bikash; Bandyopadhyay, Debasis; Mandal, Santanu
A novel one-dimensional thiocyanate-bridged cobalt(III) complex: synthesis, crystal structure characterization and Hirshfeld surface analysis.
Acta crystallographica. Section C, Structural chemistry, 2024, 80

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