Crystallography Open Database

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2020311 CIF
HKL
C8 H7 N O TeP -16.5667; 7.892; 17.2051
87.291; 86.833; 65.99
812.95Myers, Joshua P.; Fronczek, Frank R.; Junk, Thomas
The first crystal structures of six- and seven-membered tellurium- and nitrogen-containing (Te—N) heterocycles: 2<i>H</i>-1,4-benzotellurazin-3(4<i>H</i>)-one and 2,3-dihydro-1,5-benzotellurazepin-4(5<i>H</i>)-one
Acta Crystallographica Section C, 2016, 72, 1-5
2020312 CIF
HKL
C9 H9 N O TeP 1 21/c 17.7404; 9.6523; 24.4699
90; 96; 90
1818.2Myers, Joshua P.; Fronczek, Frank R.; Junk, Thomas
The first crystal structures of six- and seven-membered tellurium- and nitrogen-containing (Te—N) heterocycles: 2<i>H</i>-1,4-benzotellurazin-3(4<i>H</i>)-one and 2,3-dihydro-1,5-benzotellurazepin-4(5<i>H</i>)-one
Acta Crystallographica Section C, 2016, 72, 1-5
2020313 CIF
HKL
Paper
C20 H34 O8P 21 21 217.224; 12.935; 22.0691
90; 90; 90
2062.2Pullela, Srinivas Venkata; Acharya, Vinod; Reddy, Nagarjuna; Harlikar, Jayvant; Kulkarni, Amar; Chavan, Rakesh; Yadav, Ajay; Manna, Shuvendu; Ghosh, Angshuman
Structural corroboration of two important building blocks of the anticancer drug eribulin mesylate through two-dimensional NMR and single-crystal X-ray diffraction studies
Acta Crystallographica Section C, 2016, 72, 14-20
2020314 CIF
HKL
Paper
C17 H24 O6 SP 21 21 217.593; 8.542; 26.7
90; 90; 90
1732Pullela, Srinivas Venkata; Acharya, Vinod; Reddy, Nagarjuna; Harlikar, Jayvant; Kulkarni, Amar; Chavan, Rakesh; Yadav, Ajay; Manna, Shuvendu; Ghosh, Angshuman
Structural corroboration of two important building blocks of the anticancer drug eribulin mesylate through two-dimensional NMR and single-crystal X-ray diffraction studies
Acta Crystallographica Section C, 2016, 72, 14-20
2020315 CIF
HKL
Paper
C10 H13 Co Cu N8 OP b c m7.2703; 14.6512; 13.8246
90; 90; 90
1472.58Qin, Ying-Lian; Yao, Chen-Zhong; Yang, Bin-Wu; Qin, Jian-Fang; Gong, Qiao-Juan
Synthesis, crystal structure and magnetic properties of a two-dimensional cyanide-based heterometallic coordination polymer with cationic piperazinium ligands: poly[aquatetra-μ~2~-cyanido-κ^8^<i>C</i>:<i>N</i>-dicyanido-κ^2^<i>C</i>-(piperazinium-κ<i>N</i>^4^)cobalt(III)copper(II)]
Acta Crystallographica Section C, 2016, 72, 21-27
2020317 CIF
HKL
Paper
C10 H26 N2 Na O14 PP 1 21 111.307; 6.17; 14.678
90; 111.06; 90
955.6Ślepokura, Katarzyna Anna
3':5'-Cyclic nucleotides: two sodium salts of cdTMP
Acta Crystallographica Section C, 2016, 72, 35-47
2020318 CIF
HKL
C10 H19.4 N2 Na O10.7 PC 1 2 132.936; 19.718; 21.569
90; 112.18; 90
12971Ślepokura, Katarzyna Anna
3':5'-Cyclic nucleotides: two sodium salts of cdTMP
Acta Crystallographica Section C, 2016, 72, 35-47
2020319 CIF
HKL
Paper
C12 H42 Cl4 Ge N6 O12P -18.5247; 10.9152; 15.1592
82.98; 79.248; 70.022
1299.78Neis, Christian; Morgenstern, Bernd; Hegetschweiler, Kaspar
Hydrogen-bonding patterns in bis[2,4,6-triazaniumylcyclohexane-1,3,5-tris(olate)-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'']germanium(IV) tetrachloride hexahydrate
Acta Crystallographica Section C, 2016, 72, 28-34
2020320 CIF
HKL
Paper
C15 H14 Cl N3P 1 21/c 16.625; 22.4796; 8.6355
90; 100.61; 90
1264.07Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Similar molecular constitutions but different conformations and different supramolecular assemblies in two related fused tetracyclic benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepine derivatives
Acta Crystallographica Section C, 2016, 72, 52-56
2020321 CIF
HKL
Paper
C16 H16 Cl N3P -18.184; 9.5399; 10.2185
104.471; 101.049; 111.324
683.4Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Similar molecular constitutions but different conformations and different supramolecular assemblies in two related fused tetracyclic benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepine derivatives
Acta Crystallographica Section C, 2016, 72, 52-56
2020322 CIF
HKL
Paper
C7 H7 Cl2 Cu3 N2 O2P 1 21/n 114.4127; 10.8942; 20.2348
90; 104.84; 90
3071.2Khosa, Muhammad Kaleem; Wood, Paul T.; Humphrey, Simon M.; Harrison, William T. A.
An unusual coordination polymer containing Cu^+^ ions and featuring possible Cu···Cu `cuprophilic' interactions: poly[di-μ-chlorido-(μ~4~-3,5-diaminobenzoato-κ^4^<i>O</i>:<i>O</i>':<i>N</i>:<i>N</i>')tricopper(I)(3 <i>Cu</i>—<i>Cu</i>)]
Acta Crystallographica Section C, 2016, 72, 63-67
2020323 CIF
HKL
Paper
C15 H23.57 Cl N O1.79P 1 21/c 113.9428; 9.3285; 13.6865
90; 119.273; 90
1552.82Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A.
The dangerous new synthetic drug α-PVP as the hydrated chloride salt α-pyrrolidinopentiophenone hydrochloride 0.786-hydrate
Acta Crystallographica Section C, 2016, 72, 48-51
2020324 CIF
HKL
Paper
C26 H20 Cl2 N4P -16.1037; 9.3345; 10.4146
83.039; 77.139; 85.055
573.15Mohamed, Shaaban K.; Younes, Sabry H. H.; Abdel-Raheem, Eman M. M.; Horton, Peter N.; Akkurt, Mehmet; Glidewell, Christopher
Triclinic and monoclinic polymorphs of <i>meso</i>-(<i>E</i>,<i>E</i>)-1,1'-[1,2-bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene): the high-yield synthesis of an unexpected product, concomitant polymorphism and configurational disorder
Acta Crystallographica Section C, 2016, 72, 57-62
2020325 CIF
HKL
Paper
C26 H20 Cl2 N4C 1 2/c 122.657; 5.4399; 19.086
90; 99.967; 90
2316.9Mohamed, Shaaban K.; Younes, Sabry H. H.; Abdel-Raheem, Eman M. M.; Horton, Peter N.; Akkurt, Mehmet; Glidewell, Christopher
Triclinic and monoclinic polymorphs of <i>meso</i>-(<i>E</i>,<i>E</i>)-1,1'-[1,2-bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene): the high-yield synthesis of an unexpected product, concomitant polymorphism and configurational disorder
Acta Crystallographica Section C, 2016, 72, 57-62
2020326 CIF
HKL
C11 H13 N3 O3 S2P 1 21/n 16.5716; 16.3193; 12.8982
90; 91.219; 90
1382.94Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Mazerant, Ida; Kałużyńska, Sylwia; Foks, Henryk; Główka, Marek L.
Planarity of benzoyldithiocarbazate tuberculostatics. II. Diesters of benzoyldithiocarbazic acid
Acta Crystallographica Section C, 2016, 72, 75-79
2020327 CIF
HKL
C23 H21 N3 O3 S2P 1 21/c 128.5519; 7.9549; 21.393
90; 111.841; 90
4510.2Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Mazerant, Ida; Kałużyńska, Sylwia; Foks, Henryk; Główka, Marek L.
Planarity of benzoyldithiocarbazate tuberculostatics. II. Diesters of benzoyldithiocarbazic acid
Acta Crystallographica Section C, 2016, 72, 75-79
2020328 CIF
HKL
C16 H15 N3 O3 S2P 1 21/n 17.3383; 31.5484; 8.0521
90; 110.253; 90
1748.9Szczesio, Małgorzata; Olczak, Andrzej; Gobis, Katarzyna; Mazerant, Ida; Kałużyńska, Sylwia; Foks, Henryk; Główka, Marek L.
Planarity of benzoyldithiocarbazate tuberculostatics. II. Diesters of benzoyldithiocarbazic acid
Acta Crystallographica Section C, 2016, 72, 75-79
2020329 CIF
HKL
Paper
C22 H24 Cl3 N5 O2 Zn2P 1 21/n 19.4985; 11.3423; 23.3697
90; 98.263; 90
2491.6Wegeberg, Christina; McKee, Vickie; McKenzie, Christine J.
A coordinatively flexible hexadentate ligand gives structurally isomeric complexes <i>M</i>~2~(<i>L</i>)<i>X</i>~3~ (<i>M</i> = Cu, Zn; <i>X</i> = Br, Cl)
Acta Crystallographica Section C, 2016, 72, 68-74
2020330 CIF
HKL
Paper
C22 H24 Br3 N5 O2 Zn2P c a 2118.7061; 13.3342; 20.4516
90; 90; 90
5101.3Wegeberg, Christina; McKee, Vickie; McKenzie, Christine J.
A coordinatively flexible hexadentate ligand gives structurally isomeric complexes <i>M</i>~2~(<i>L</i>)<i>X</i>~3~ (<i>M</i> = Cu, Zn; <i>X</i> = Br, Cl)
Acta Crystallographica Section C, 2016, 72, 68-74
2020331 CIF
HKL
Paper
C44 H63 Br6 Cu4 N10 O11.5P -111.2516; 15.0606; 18.3213
112.087; 94.38; 90.486
2866.1Wegeberg, Christina; McKee, Vickie; McKenzie, Christine J.
A coordinatively flexible hexadentate ligand gives structurally isomeric complexes <i>M</i>~2~(<i>L</i>)<i>X</i>~3~ (<i>M</i> = Cu, Zn; <i>X</i> = Br, Cl)
Acta Crystallographica Section C, 2016, 72, 68-74
2020332 CIF
HKL
Paper
F4 H6 O5 V2C 1 2/c 114.453; 4.8879; 9.663
90; 103.24; 90
664.5Black, Cameron; Lightfoot, Philip
V~2~O~2~F~4~(H~2~O)~2~·H~2~O: a new V^4+^ layer structure related to VOF~3~
Acta Crystallographica Section C, 2016, 72, 80-83
2020333 CIF
HKL
Paper
C21 H22 Cl4 N14 O4P -110.8229; 11.7395; 12.7637
62.633; 70.877; 81.182
1360.7Gerhardt, Valeska; Bolte, Michael
6-Chloroisocytosine and 5-bromo-6-methylisocytosine: again, one or two tautomers present in the same crystal?
Acta Crystallographica Section C, 2016, 72, 84-93
2020334 CIF
HKL
Paper
C63 H66 Cl12 N42 O12P -114.0097; 14.0185; 21.4229
83.774; 84; 83.554
4137.9Gerhardt, Valeska; Bolte, Michael
6-Chloroisocytosine and 5-bromo-6-methylisocytosine: again, one or two tautomers present in the same crystal?
Acta Crystallographica Section C, 2016, 72, 84-93
2020335 CIF
HKL
Paper
C5 H6 Br N3 OP 1 21/n 19.8154; 9.9532; 14.344
90; 108.021; 90
1332.6Gerhardt, Valeska; Bolte, Michael
6-Chloroisocytosine and 5-bromo-6-methylisocytosine: again, one or two tautomers present in the same crystal?
Acta Crystallographica Section C, 2016, 72, 84-93
2020336 CIF
HKL
Paper
C15 H21 Br2 N7 O3P 1 21/n 111.7075; 14.0308; 11.8308
90; 103.096; 90
1892.8Gerhardt, Valeska; Bolte, Michael
6-Chloroisocytosine and 5-bromo-6-methylisocytosine: again, one or two tautomers present in the same crystal?
Acta Crystallographica Section C, 2016, 72, 84-93
2020337 CIF
HKL
Paper
C9.64 H11.27 Br1.64 Cl0.37 N6 O2P 1 21/n 19.27; 11.423; 12.559
90; 98.61; 90
1314.9Gerhardt, Valeska; Bolte, Michael
6-Chloroisocytosine and 5-bromo-6-methylisocytosine: again, one or two tautomers present in the same crystal?
Acta Crystallographica Section C, 2016, 72, 84-93
2020338 CIFC6 Ag3 K2 N6 NaP -3 1 m7.0509; 7.0509; 8.5766
90; 90; 120
369.262Zabel, M.; Kuehnel, S.; Range, K.J.
Dipotassium sodium tris(dicyanoargentate(I))
Acta Crystallographica C (39,1983-), 1989, 45, 1619-1621
2020339 CIFN3 O11 Rb UR -3 c :H9.384; 9.384; 18.899
90; 90; 120
1441.27Zalkin, A.; Templeton, L.K.; Templeton, D.H.
Structure of rubidium uranyl(VI) trinitrate
Acta Crystallographica C (39,1983-), 1989, 45, 810-811
2020340 CIFRe3.345 Sc7 Si10.654I 4/m m m9.8123; 9.8123; 14.274
90; 90; 90
1374.32Zhao, J.-T.; Chabot, B.; Parthe, E.
Sc7Re4Si10, a ternary substitution variant of the Ho11Ge10 type
Acta Crystallographica C (39,1983-), 1988, 44, 397-399
2020341 CIFNi2 Sc3 Si3C m c m3.9812; 9.688; 13.111
90; 90; 90
505.69Zhao, J.T.; Parthe, E.
Sc3 Ni2 Si3 with Hf3 Ni2 Si3-type structure, an intergrowth of Cr B-, Th Cr2 Si2- and W-type slabs
Acta Crystallographica C (39,1983-), 1989, 45, 1853-1856
2020342 CIFCs2 O4 SeP n a m8.3777; 11.276; 6.434
90; 90; 90
607.8Zuniga, F.J.; Breczewski, T.; Arnaiz, A.
Structure of cesium selenate
Acta Crystallographica C (39,1983-), 1991, 47, 638-640
2020343 CIFFe H5 O9 P2P 1 21/c 15.191; 8.748; 14.448
90; 94.81; 90
653.786Vencato, I.; Mattievich, E.; Moreira, L.F.; Mascarenhas, Y.P.
The structure of ferric oxonium bis(hydrogenphosphate), Fe(3+) (H3 O)(+) (P O4 H)2(2-)
Acta Crystallographica C (39,1983-), 1989, 45, 367-371
2020344 CIFCs O7 P2 VP 1 21/c 17.701; 9.997; 8.341
90; 104.82; 90
620.786Wang, Y.P.; Lii, K.-H.
Structure of Cs V P22 O7
Acta Crystallographica C (39,1983-), 1989, 45, 1210-1211
2020345 CIFNa O7 P2 VP 1 21/c 17.324; 7.93; 9.586
90; 111.96; 90
516.354Wang, Y.P.; Lii, K.-H.; Wang, S.-L.
Structure of Na V P2 O7
Acta Crystallographica C (39,1983-), 1989, 45, 1417-1418
2020346 CIFCl4 Cs2 O2 UC 1 2/m 111.929; 7.704; 5.816
90; 100.02; 90
526.344Watkin, D.J.; Prout, K.; Denning, R.G.
Structure of dicesium tetrachlorodioxouranium(VI)
Acta Crystallographica C (39,1983-), 1991, 47, 2517-2519
2020347 CIFHf S3 SnP n m a9.139; 3.694; 13.875
90; 90; 90
468.413Wiegers, G.A.; Meetsma, A.; Haange, R.J.; de Boer, J.L.
Structure of tin hafnium sulfide and lead hafnium sulfide
Acta Crystallographica C (39,1983-), 1989, 45, 847-849
2020348 CIFHf Pb S3P n m a8.988; 3.739; 13.924
90; 90; 90
467.932Wiegers, G.A.; Meetsma, A.; Haange, R.J.; de Boer, J.L.
Structure of tin hafnium sulfide and lead hafnium sulfide
Acta Crystallographica C (39,1983-), 1989, 45, 847-849
2020349 CIFBa4 O6 PtR -3 c :H10.2101; 10.2101; 12.6172
90; 90; 120
1139.08Wilkinson, A.P.; Cheetham, A.K.
The structure of Ba4 Pt O6 from time-of-flight powder neutron diffraction data
Acta Crystallographica C (39,1983-), 1989, 45, 1672-1674
2020350 CIFGa40.88 Mo8 S0.86I 4/m12.861; 12.861; 5.284
90; 90; 90
874.002Wolcyrz, M.; Andruszkiewicz, R.; Lukaszewicz, K.
Structure of Mo8 Ga41 S
Acta Crystallographica C (39,1983-), 1989, 45, 991-993
2020351 CIFPd7 Se2P 1 21/c 110.62; 5.37; 9.441
90; 148.87; 90
278.35Sato, S.; Takabatake, T.; Ishikawa, M.
Structures of superconducting palladium selenides, Pd7 Se2 and Pd34 Se11
Acta Crystallographica C (39,1983-), 1989, 45, 1-3
2020352 CIFPd34 Se11P 1 21/c 112.03; 5.504; 22.776
90; 111.96; 90
1398.65Sato, S.; Takabatake, T.; Ishikawa, M.
Structures of superconducting palladium selenides, Pd7 Se2 and Pd34 Se11
Acta Crystallographica C (39,1983-), 1989, 45, 1-3
2020353 CIFAl54.75 Re14P -15.159; 9.106; 23.755
100.94; 90.3; 93
1094.05Schuster, J.C.; Parthe, E.
Triclinic Re Al~4, a periodic domain structure variant of the monoclinic W Al4 type
Acta Crystallographica C (39,1983-), 1987, 43, 620-623
2020354 CIFFe2 H3 O9 P3P 63/m8.037; 8.037; 7.352
90; 90; 120
411.267Sghyar, M.; Rafiq, M.; Cot, L.; Durand, J.
Structure du phosphite de fer: Fe2 (P O3 H)3
Acta Crystallographica C (39,1983-), 1991, 47, 2515-2517
2020355 CIFCd Cs2 I4P 1 21/m 17.827; 8.397; 11.05
90; 110.76; 90
679.09Sjoevall, R.
Structure of dicesium tetraiodocadmiate(II)
Acta Crystallographica C (39,1983-), 1989, 45, 667-669
2020356 CIFBa Br2 H2 O7I 1 2/c 19.0696; 7.8952; 9.6295
90; 93.26; 90
688.417Templeton, L.K.; Templeton, D.H.
Structure of barium bromate monohydrate
Acta Crystallographica C (39,1983-), 1989, 45, 672-673
2020357 CIFCs O7 Sb Si2P n a 2121.024; 13.602; 7.1287
90; 90; 90
2038.58Pagnoux, C.; Verbaere, A.; Tournoux, M.; Piffard, Y.
CsSbO(SiO3)2: A new (uB, 1-1-infinite)(12SiO3) chain silicate
Acta Crystallographica C (39,1983-), 1991, 47, 2297-2299
2020358 CIFC5 Br O5 ReP n m a11.886; 11.644; 6.1888
90; 90; 90
856.534Porter, L.C.; Reid, A.H.; Fackler, J.P.jr.
Structure of bromopentacarbonylrhenium(I)
Acta Crystallographica C (39,1983-), 1992, 48, 908-909
2020359 CIFC2 Ag N2 NaC 1 2/c 16.572; 3.71; 17.346
90; 92.05; 90
422.662Range, K.J.; Kuehnel, S.; Zabel, M.
Sodium dicyanoargentate(I)
Acta Crystallographica C (39,1983-), 1989, 45, 1419-1420
2020360 CIFIn2 Mn2 Se5R -3 m :H4.016; 4.016; 48.734
90; 90; 120
680.691Range, K.J.; Klement, U.; Doell, G.; Bucher, E.; Baumann, J.R.
Dimanganese diindium pentaselenide, Mn2 In2 Se5
Acta Crystallographica C (39,1983-), 1992, 48, 355-356
2020361 CIFCu H4 Na2 O4P n a 216.75; 6.726; 8.993
90; 90; 90
408.287Riou, A.; Cudennec, Y.; Gerault, Y.
Copper disodium tetrahydroxide
Acta Crystallographica C (39,1983-), 1989, 45, 374-376
2020362 CIFCo3 H16 O16 P2C 1 2/m 110.021; 13.331; 4.673
90; 104.9; 90
603.276Riou, A.; Cudennec, Y.; Gerault, Y.
Cobalt(II) orthophosphate octahydrate
Acta Crystallographica C (39,1983-), 1989, 45, 1412-1413
2020363 CIFBa2 O4 PbI 4/m m m4.2965; 4.2965; 13.2285
90; 90; 90
244.197Rosseinsky, M.J.; Prassides, K.
Time-of-flight powder neutron diffraction study of the structure ofBa2PbO4
Acta Crystallographica C (39,1983-), 1991, 47, 2519-2522
2020364 CIFCa O6 P2P 1 21/a 116.96; 7.7144; 6.9963
90; 90.394; 90
915.348Rothammel, W.; Burzlaff, H.; Specht, R.
Structure of calcium metaphosphate Ca (P O3)2
Acta Crystallographica C (39,1983-), 1989, 45, 551-553
2020365 CIFN8 S7 Tl2P n m a11.38; 9.281; 11.714
90; 90; 90
1237.21Martan, H.; Weiss, J.
Dithalliumtrischwefeltrinitrid-tetraschwefelpentanitrid, Tl2 S7 N8
Acta Crystallographica C (39,1983-), 1983, 39, 959-960
2020366 CIFCl4 K2 ZnC 1 c 114.394; 24.544; 26.616
90; 89.98; 90
9403.07Mashiyama, H.
Low-temperature commensurate phase of potassium tetrachlorozincate, K2 Zn Cl4
Acta Crystallographica C (39,1983-), 1993, 49, 9-12
2020367 CIFDy2 S3P n m a10.609; 3.864; 10.429
90; 90; 90
427.518Meetsma, A.; Wiegers, G.A.; Haange, R.J.; de Boer, J.L.; Boom, G.
Structure of two modifications of dysprosium sesquisulfide, Dy2S3
Acta Crystallographica C (39,1983-), 1991, 47, 2287-2291
2020368 CIFBa Cu O7 P2P -17.353; 7.578; 5.231
90.83; 95.58; 103
282.462Moqine, A.; Boukhari, A.; Holt, E.M.
Structure of BaCuP2O7
Acta Crystallographica C (39,1983-), 1991, 47, 2294-2297
2020369 CIFAg H K N2 O4.5C m c e25.715; 12.857; 6.787
90; 90; 90
2243.9Okamura, Y.; Ishihara, M.; Ohba, S.; Saito, Y.
Structure of tetrapotassium trisilver heptanitrite and potassium silver dinitrite hemihydrate
Acta Crystallographica C (39,1983-), 1989, 45, 353-356
2020370 CIFC15.9996 H38.44 Fe2.6666 N15.9996 O19.22 Zn3.9999F m -3 m10.342; 10.342; 10.342
90; 90; 90
1106.15Gravereau, P.; Garnier, E.
Structure de la Phase Cubique de l'Hexacyanoferrate(III) de Zinc: Zn3(Fe(C N)6)2 * n H2 O
Acta Crystallographica C (39,1983-), 1984, 40, 1306-1309
2020371 CIFD4 Mo O5P 1 21/n 110.487; 13.85; 10.617
90; 91.62; 90
1541.45Crouch-Baker, S.; Dickens, P.G.
The deuterium-atom positions in deuterated molybdic acid, Mo O3 (D2 O)2, by powder neutron diffraction
Acta Crystallographica C (39,1983-), 1984, 40, 1121-1124
2020372 CIFBi2 H88 Na6 Ni1.62 O112 W20.38P 1 21/n 112.889; 25.096; 16.189
90; 94.812; 90
5218.08Rosu, C.; Weakley, T.J.R.
Hexasodium tetrahydrogen (di(triaquanickelo)icosatungstodibismuthate(III)(10-)) 36-hydrate, Na6 H4 (Bi2 Ni2 W20 O70 (H2 O)6) . 36(H2 O)
Acta Crystallographica C (39,1983-), 1999, 55, 1-1
2020373 CIFAl24 H32 Na13 O112 P11 Si13I 41 3 213.729; 13.729; 13.729
90; 90; 90
2587.72Artioli, G.; Pluth, J.J.; Smith, J.V.
Synthetic Phosphorus-Substituted Analcime, Na13 Al24 Si13 P11 O96 * 16H2 O, with Ordered Al and Si/P
Acta Crystallographica C (39,1983-), 1984, 40, 214-217
2020374 CIFB5 Cs H8 O12P 1 21/c 111.584; 7.174; 13.959
90; 94.61; 90
1156.29Behm, H.
Structure determination on a twinned crystal of cesium pentaborate tetrahydrate, Cs (B5 O6 (O H)4) (H2 O)2
Acta Crystallographica C (39,1983-), 1984, 40, 1114-1116
2020375 CIFNa7 Nb15 O80 W13P m a b21.962; 17.763; 3.9165
90; 90; 90
1527.87Marinder, B.O.; Sundberg, M.R.
Na7 Nb15 W13 O80 - A New Type of Tunnel Structure Studied by X-ray Diffraction and HREM Techniques
Acta Crystallographica C (39,1983-), 1984, 40, 1303-1306
2020376 CIFPb4 S13 Sb6I 1 2/m 123.698; 3.98; 24.466
90; 93.9; 90
2302.24Skowron, A.; Brown, I.D.
Refinement of the structure of robinsonite, Pb4 Sb6 S13
Acta Crystallographica C (39,1983-), 1990, 46, 527-531
2020377 CIFBi Cr4 O14 RbP 1 21/a 18.34; 17.069; 8.813
90; 91.47; 90
1254.17Gerault, Y.; Cudennec, Y.; Riou, A.; le Marouille, J.Y.
Bis(dichromate) de bismuth et de rubidium, Rb Bi (Cr2 O7)2
Acta Crystallographica C (39,1983-), 1984, 40, 220-222
2020378 CIFBa2 O4 TiP 21 n b6.107; 22.952; 10.54
90; 90; 90
1477.37Guenter, J.R.; Jameson, G.B.
Orthorhombic barium orthotitanate, alpha'-Ba2 Ti O4
Acta Crystallographica C (39,1983-), 1984, 40, 207-210
2020379 CIFF6 Hg2.881 NbI 41/a m d :27.692; 7.692; 12.679
90; 90; 90
750.177Tun, Z.; Brown, I.D.; Ummat, P.K.
The Room-Temperature Structures of Mercury Niobium Fluoride, Hg3-d Nb F6, and Mercury Tantalum Fluoride, Hg3-d Ta F6
Acta Crystallographica C (39,1983-), 1984, 40, 1301-1303
2020380 CIFF6 Hg2.884 TaI 41/a m d :27.711; 7.711; 12.714
90; 90; 90
755.968Tun, Z.; Brown, I.D.; Ummat, P.K.
The Room-Temperature Structures of Mercury Niobium Fluoride, Hg3-d Nb F6, and Mercury Tantalum Fluoride, Hg3-d Ta F6
Acta Crystallographica C (39,1983-), 1984, 40, 1301-1303
2020381 CIFB5 H8 O12 RbA e a 211.302; 10.962; 9.335
90; 90; 90
1156.54Behm, H.
Rubidium Pentaborate Tetrahydrate, Rb (B5 O6 (O H)4) (H2 O)2
Acta Crystallographica C (39,1983-), 1984, 40, 217-220
2020382 CIFBr4 Ca H16 Mn O8C 1 2/m 19.062; 9.582; 9.405
90; 112.96; 90
751.958Duhlev, R.; Brown, I.D.
Structure of calcium manganese(II) tetrabromide octahydrate
Acta Crystallographica C (39,1983-), 1990, 46, 538-541
2020383 CIFPb2 S5 Sb2P b n m11.355; 19.783; 4.042
90; 90; 90
907.979Skowron, A.; Brown, I.D.
Structure of Pb2 Sb2 S5
Acta Crystallographica C (39,1983-), 1990, 46, 534-536
2020384 CIFCa H18 N O11 PP 1 21 16.3; 11.929; 7.176
90; 91.62; 90
539.08Takagi, S.; Brown, W. E.; Mathew, M.
Structure of Ammonium Calcium Phosphate Heptahydrate, Ca (N H4) P O4 (H2 O)7
Acta Crystallographica C (39,1983-), 1984, 40, 1111-1113
2020385 CIF
HKL
Paper
C10 H10 Cl N O2P 21 21 214.1713; 14.7792; 16.1755
90; 90; 90
997.19Ashraf, Zaman; Kim, Daeyoung; Seo, Sung-Yum; Kang, Sung Kwon
Synthesis and crystal structures of the potential tyrosinase inhibitors <i>N</i>-(4-acetylphenyl)-2-chloroacetamide and 2-(4-acetylanilino)-2-oxoethyl cinnamate
Acta Crystallographica Section C, 2016, 72, 94-98
2020386 CIF
HKL
Paper
C19 H17 N O4P c a 219.7969; 17.594; 9.6425
90; 90; 90
1662Ashraf, Zaman; Kim, Daeyoung; Seo, Sung-Yum; Kang, Sung Kwon
Synthesis and crystal structures of the potential tyrosinase inhibitors <i>N</i>-(4-acetylphenyl)-2-chloroacetamide and 2-(4-acetylanilino)-2-oxoethyl cinnamate
Acta Crystallographica Section C, 2016, 72, 94-98
2020388 CIF
HKL
Paper
C12 H18 Cl2 N2 O2P -15.3844; 7.3682; 9.7405
104.395; 102.234; 97.2263
359.25Rukiah, Mwaffak; Al-Ktaifani, Mahmoud M.; Sabra, Mohammad K.
Reaction-path calculations and crystal structures of 1,1'-(ethylene-1,2-diyl)dipyridinium dichloride dihydrate and 1,1'-(ethylene-1,2-diyl)dipyridinium dibromide
Acta Crystallographica Section C, 2016, 72
2020389 CIF
HKL
C12 H14 Br2 N2P -15.7608; 6.4257; 9.6848
80.7074; 81.2351; 70.8554
332.33Rukiah, Mwaffak; Al-Ktaifani, Mahmoud M.; Sabra, Mohammad K.
Reaction-path calculations and crystal structures of 1,1'-(ethylene-1,2-diyl)dipyridinium dichloride dihydrate and 1,1'-(ethylene-1,2-diyl)dipyridinium dibromide
Acta Crystallographica Section C, 2016, 72
2020390 CIF
HKL
Paper
C21 H22 O8P 21 21 2119.3239; 22.921; 4.1385
90; 90; 90
1833Noguchi, Shuji; Atsumi, Haruka; Iwao, Yasunori; Kan, Toshiyuki; Itai, Shigeru
Nobiletin: a citrus flavonoid displaying potent physiological activity
Acta Crystallographica Section C, 2016, 72, 124-127
2020391 CIF
HKL
Paper
C11 H15 N O4P 1 21 16.7342; 7.8271; 10.7822
90; 96.442; 90
564.73Smith, Graham; Lynch, Daniel E.
Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues
Acta Crystallographica Section C, 2016, 72, 105-111
2020392 CIF
HKL
Paper
C11 H13 N3 O8I 1 2/a 117.8382; 10.322; 14.5599
90; 101.06; 90
2631.1Smith, Graham; Lynch, Daniel E.
Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues
Acta Crystallographica Section C, 2016, 72, 105-111
2020393 CIF
HKL
Paper
C11 H13 N3 O7C 1 2/c 121.208; 5.6443; 23.9753
90; 116.326; 90
2572.3Smith, Graham; Lynch, Daniel E.
Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues
Acta Crystallographica Section C, 2016, 72, 105-111
2020394 CIF
HKL
Paper
C11 H15 N3 O5P 1 21/n 19.1015; 7.1128; 19.2693
90; 91.233; 90
1247.15Smith, Graham; Lynch, Daniel E.
Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues
Acta Crystallographica Section C, 2016, 72, 105-111
2020395 CIF
HKL
C24 H16 N4 O8 ZnP 1 21/c 120.526; 7.5873; 15.473
90; 105.598; 90
2321Tang, Long; Wang, Ji-Jiang; Fu, Feng; Wang, Sheng-Wen; Liu, Qi-Rui
A threefold interpenetrated two-dimensional zinc(II) supramolecular architecture based on 3-nitrobenzoic acid and 4,4'-bipyridine
Acta Crystallographica Section C, 2016, 72, 128-132
2020396 CIF
HKL
Paper
C32 H40 Cu4 N8 O12 S2P -18.4421; 11.435; 11.909
111.67; 107.76; 95.87
987Jiao, Chen; Zhang, Si-Si; Li, Zuo-Yin; Liu, Jian-Jun; Lin, Mei-Jin; Huang, Chang-Cang
Syntheses and structures of discrete copper(II) and cadmium(II) supramolecular complexes based on 1,4-diacylthiosemicarbazone ligands
Acta Crystallographica Section C, 2016, 72, 119-123
2020397 CIF
HKL
Paper
C42 H44 Cd2 N12 O14 S2P -19.959; 10.531; 12.617
81.35; 82.13; 65.6
1187.2Jiao, Chen; Zhang, Si-Si; Li, Zuo-Yin; Liu, Jian-Jun; Lin, Mei-Jin; Huang, Chang-Cang
Syntheses and structures of discrete copper(II) and cadmium(II) supramolecular complexes based on 1,4-diacylthiosemicarbazone ligands
Acta Crystallographica Section C, 2016, 72, 119-123
2020398 CIF
HKL
Paper
C42 H34 N4 O14 Zn2P -19.5585; 10.0434; 10.6027
92.365; 94.032; 103.509
985.5Lu, Ji-Tao; Meng, Dan-Dan; Meng, Qing-Guo
Assembly of Zn^II^ and Cd^II^ coordination polymers based on a flexible multicarboxylate ligand and nitrogen-containing auxiliary ligands through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties
Acta Crystallographica Section C, 2016, 72, 99-104
2020399 CIF
HKL
Paper
C52 H44 Cd2 N6 O14P -16.8275; 12.7613; 14.877
106.134; 101.602; 97.496
1195.55Lu, Ji-Tao; Meng, Dan-Dan; Meng, Qing-Guo
Assembly of Zn^II^ and Cd^II^ coordination polymers based on a flexible multicarboxylate ligand and nitrogen-containing auxiliary ligands through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties
Acta Crystallographica Section C, 2016, 72, 99-104
2020400 CIF
HKL
Paper
C16 H37 Cl N4 O7P -18.3119; 10.7358; 12.2031
106.332; 90.296; 93.842
1042.33Jurek, Paul; Reibenspies, Joseph H.; Kiefer, Garry E.
CB-TE2A^+^·Cl^{-^}·3H~2~O: a short intermolecular hydrogen bond between zwitterionic bicyclo[6.6.2]tetraamine macrocycles
Acta Crystallographica Section C, 2016, 72, 139-142
2020401 CIF
HKL
Paper
C13 H9 N O4 ZnP 1 21/n 17.3974; 16.5945; 10.3281
90; 104.815; 90
1225.7Zhou, Li-Juan; Han, Chang-Bao; Wang, Yu-Ling
Two-dimensional Zn^II^ and one-dimensional Co^II^ coordination polymers based on benzene-1,4-dicarboxylate and pyridine ligands
Acta Crystallographica Section C, 2016, 72, 133-138
2020402 CIF
HKL
C18 H16 Co N2 O5C 1 2/c 120.8487; 8.9363; 20.736
90; 117.032; 90
3441.3Zhou, Li-Juan; Han, Chang-Bao; Wang, Yu-Ling
Two-dimensional Zn^II^ and one-dimensional Co^II^ coordination polymers based on benzene-1,4-dicarboxylate and pyridine ligands
Acta Crystallographica Section C, 2016, 72, 133-138
2020403 CIF
Paper
C30 H38 Co2 N2 O18P 1 21/n 113.1337; 9.8973; 14.5191
90; 116.449; 90
1689.77Xie, Min; Xu, Guo-Hai
Bis(triethanolamine)bis(μ~2~-trimesato)dicobalt(II): a Co^II^ dimer with an unreported two-dimensional supramolecular topology formed from triethanolamine and trimesic acid ligands
Acta Crystallographica Section C, 2016, 72, 143-148
2020404 CIF
HKL
Paper
C23 H20 Cu2 N8 O2P -110.114; 10.1578; 11.9844
72.725; 87.397; 78.487
1151.91Hopa, Cigdem; Cokay, Ismail
Synthesis, structural characterization and thermal properties of a new copper(II) one-dimensional coordination polymer based on bridging <i>N</i>,<i>N</i>'-bis(2-hydroxybenzylidene)-2,2-dimethylpropane-1,3-diamine and dicyanamide ligands
Acta Crystallographica Section C, 2016, 72, 149-154
2020405 CIF
HKL
Paper
C62 H64 Mo2 N10 Ni6 O23P -110.5079; 12.7461; 14.585
111.551; 95.979; 98.854
1767.6Dou, Ming-Yu; Lu, Jing
A novel octanuclear nickel(II)‒molybdenum(VI) heterometallic cluster based on the salicylhydroxamate ligand
Acta Crystallographica Section C, 2016, 72, 161-165
2020406 CIF
HKL
Paper
C4 H10 N8 Na2 O6P b c a6.4055; 11.587; 15.805
90; 90; 90
1173.1Guo, Jiajia; Cao, Wenli; Li, Shuailei; Miao, Kanghua; Song, Jirong; Huang, Jie
Synthesis and crystal structure of a two-dimensional sodium coordination polymer of 4,4'-(diazenediyl)bis(1<i>H</i>-1,2,4-triazol-5-one)
Acta Crystallographica Section C, 2016, 72, 166-169
2020407 CIF
HKL
Paper
C15 H15 Cl N2 OP 21 21 215.4867; 9.8381; 50.3061
90; 90; 90
2715.5Buist, Amanda R.; Kennedy, Alan R.
Salt forms of the pharmaceutical amide dihydrocarbamazepine
Acta Crystallographica Section C, 2016, 72, 155-160
2020408 CIF
HKL
Paper
C15 H17 Cl N2 O2P 1 21/c 15.3048; 24.4966; 11.0163
90; 96.731; 90
1421.7Buist, Amanda R.; Kennedy, Alan R.
Salt forms of the pharmaceutical amide dihydrocarbamazepine
Acta Crystallographica Section C, 2016, 72, 155-160
2020409 CIF
HKL
Paper
C15 H17 Br N2 O2P 1 21/c 15.4857; 24.5526; 10.9796
90; 96.931; 90
1468.02Buist, Amanda R.; Kennedy, Alan R.
Salt forms of the pharmaceutical amide dihydrocarbamazepine
Acta Crystallographica Section C, 2016, 72, 155-160
2020410 CIF
HKL
C30 H34 Cl2 Co N10 O6P -18.5194; 10.0059; 10.2685
82.304; 84.182; 78.163
846.53Zhong, Di-Chang; Wen, Ya-Qiong; Deng, Ji-Hua; Jian, Tao-Hua; Wang, Ke-Jun
Two cobalt(II) supramolecular isomers based on <i>N</i>,<i>N</i>'-bis(pyridin-3-yl)oxalamide induced by the molecular orientation of lattice DMF molecules
Acta Crystallographica Section C, 2016, 72, 170-173
2020411 CIF
HKL
C30 H34 Cl2 Co N10 O6P -19.2991; 9.3832; 10.7003
66.316; 79.647; 85.347
841.06Zhong, Di-Chang; Wen, Ya-Qiong; Deng, Ji-Hua; Jian, Tao-Hua; Wang, Ke-Jun
Two cobalt(II) supramolecular isomers based on <i>N</i>,<i>N</i>'-bis(pyridin-3-yl)oxalamide induced by the molecular orientation of lattice DMF molecules
Acta Crystallographica Section C, 2016, 72, 170-173
2020413 CIF
HKL
Paper
C17 H12 Cd N O5C 1 2/c 119.49; 9.985; 15.54
90; 96.25; 90
3006.2Yu, Cai-Xia; Gao, Yan-Ping; Cui, Xiao-Qing; Guo, Meng-Jiao; Liu, Lei-Lei
The crystal structure and photocatalytic properties of a three-dimensional cadmium(II) metal‒organic framework: poly[bis(μ~3~-benzene-1,2-dicarboxylato)[μ~2~-1,4-bis(pyridin-3-ylmethoxy)benzene]dicadmium(II)]
Acta Crystallographica Section C, 2016, 72, 174-178
2020414 CIF
HKL
Paper
C41 H44 O5.3P 21 21 219.5183; 9.595; 36.207
90; 90; 90
3306.7Guzei, Ilia A.; Miles, Kelsey C.
<i>Ab initio</i> X-ray structural characterization of an inclusion compound with a compositionally disordered chiral guest: no prior knowledge of the crystal composition
Acta Crystallographica Section C, 2016, 72, 179-183
2020415 CIF
HKL
Paper
C22 H11 B F12P 21 21 218.3748; 18.2499; 27.5695
90; 90; 90
4213.7Samigullin, Kamil; Soltani, Yashar; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
Conformational studies on heteroleptic trifluoromethyl-substituted phenylboranes
Acta Crystallographica Section C, 2016, 72, 189-197
2020416 CIF
HKL
Paper
C24 H9 B F18P -18.2059; 8.7103; 18.0982
103.491; 95.43; 99.093
1230.38Samigullin, Kamil; Soltani, Yashar; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
Conformational studies on heteroleptic trifluoromethyl-substituted phenylboranes
Acta Crystallographica Section C, 2016, 72, 189-197
2020417 CIF
HKL
Paper
C24 H9 B F18P -110.8257; 11.4704; 12.0198
117.067; 101.774; 100.795
1232.1Samigullin, Kamil; Soltani, Yashar; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
Conformational studies on heteroleptic trifluoromethyl-substituted phenylboranes
Acta Crystallographica Section C, 2016, 72, 189-197
2020418 CIF
HKL
Paper
C26 H25 B F6P 1 21/n 18.35; 34.37; 8.5512
90; 107.062; 90
2346.1Samigullin, Kamil; Soltani, Yashar; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
Conformational studies on heteroleptic trifluoromethyl-substituted phenylboranes
Acta Crystallographica Section C, 2016, 72, 189-197
2020419 CIF
HKL
Paper
C16 H6 B F13P 1 21/n 112.9807; 9.2709; 15.269
90; 113.455; 90
1685.7Samigullin, Kamil; Soltani, Yashar; Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael
Conformational studies on heteroleptic trifluoromethyl-substituted phenylboranes
Acta Crystallographica Section C, 2016, 72, 189-197
2020420 CIF
HKL
Paper
C17 H19 F2 N3 O PtP 21 21 214.5317; 12.6474; 28.675
90; 90; 90
1643.5Raven, William; Joschko, Thomas; Kalf, Irmgard; Englert, Ulli
Hydrogen <i>versus</i> fluorine: effects on molecular structure and intermolecular interactions in a platinum isocyanate complex
Acta Crystallographica Section C, 2016, 72, 184-188
2020421 CIF
HKL
Paper
C16 H16 F6 N4 O6 S2P 1 21/c 111.37505; 16.09785; 11.60677
90; 96.0475; 90
2113.53Duhayon, Carine; Canac, Yves; Dubrulle, Laurent; Maaliki, Carine; Chauvin, Remi
The search for formal electrostatic effects on molecular conformation and crystal packing: crystal structure of 2,2''-disubstituted (H <i>versus</i> PPh~2~) 1,1'-(1,2-phenylene)bis(3-methyl-1<i>H</i>-imidazol-3-ium) bis(trifluoromethanesulfonate)
Acta Crystallographica Section C, 2016, 72, 198-202
2020422 CIF
HKL
Paper
C14 H15 N5 O3P 4110.281404; 10.281404; 26.15892
90; 90; 90
2765.19Fischer, Franziska; Schmidt, Martin U.; Greiser, Sebastian; Emmerling, Franziska
The challenging case of the theophylline‒benzamide cocrystal
Acta Crystallographica Section C, 2016, 72, 217-224
2020423 CIF
HKL
Paper
C30 H60 Cl6 Hg3 N6 O2 P2P 1 21/n 111.1182; 10.5995; 19.338
90; 96.337; 90
2265Saneei, Anahid; Pourayoubi, Mehrdad; Crochet, Aurelien; Fromm, Katharina M.
The first phosphoramide‒mercury(II) complex with a Cl~2~Hg‒OP[N(C)(C)]~3~ segment
Acta Crystallographica Section C, 2016, 72, 230-233
2020424 CIF
HKL
Paper
C9 H24 N2 O5C 1 2/c 110.6114; 6.3184; 19.063
90; 104.075; 90
1239.7Ben Nasr, Mahjouba; Aubert, Emmanuel; Espinosa, Enrique
A comparative study of two polymorphs of bis(1-hydroxy-2-methylpropan-2-aminium) carbonate
Acta Crystallographica Section C, 2016, 72, 225-229
2020425 CIF
HKL
Paper
C32 H22 Cu N4 O2P -19.7987; 10.3849; 13.9923
79.948; 69.724; 66.911
1227.39Chatturgoon, Teshica; Akerman, Matthew P.
X-ray and DFT-calculated structures of bis[<i>N</i>-(quinolin-8-yl)benzamidato-κ^2^<i>N</i>,<i>N</i>']copper(II)
Acta Crystallographica Section C, 2016, 72, 234-238
2020426 CIF
HKL
Paper
C4 H8 Fe Na O12I 419.8572; 9.8572; 10.7595
90; 90; 90
1045.44Benhacine, Mohamed Al Amine; Hamadène, Malika; Bouacida, Sofiane; Merazig, Hocine
The new one-dimensional coordination polymer <i>catena</i>-poly[[diaquasodium(I)]-μ-oxalato-[diaquairon(III)]-μ-oxalato]
Acta Crystallographica Section C, 2016, 72, 243-250
2020427 CIF
HKL
Paper
C41.5 H40 Cl6 Cu2 N8 O9C 1 2/c 133.62; 14.897; 20.948
90; 110.544; 90
9824Barati, Kazem; Clegg, William; Habibi, Mohammad Hossein; Harrington, Ross W.; Lalegani, Arash; Montazerozohori, Morteza
Synthesis and crystal structure of the dinuclear copper(II) Schiff base complex μ-hydroxido-μ-chlorido-bis{[bis(<i>trans</i>-2-nitrocinnamaldehyde)ethylenediamine]chloridocopper(II)} dichloromethane sesquisolvate
Acta Crystallographica Section C, 2016, 72, 239-242
2020430 CIF
HKL
Paper
C21 H15 Cl F4 N4 O3P 1 21/c 17.6972; 24.3703; 11.358
90; 93.545; 90
2126.5Sun, Meng-Ying; Wu, Su-Xiang; Zhou, Xin-Bo; Gu, Jian-Ming; Hu, Xiu-Rong
Comparison of the crystal structures of the potent anticancer and anti-angiogenic agent regorafenib and its monohydrate
Acta Crystallographica Section C, 2016, 72, 291-296
2020431 CIF
HKL
Paper
C21 H17 Cl F4 N4 O4P 1 21/c 14.7783; 21.9538; 20.5581
90; 92.341; 90
2154.78Sun, Meng-Ying; Wu, Su-Xiang; Zhou, Xin-Bo; Gu, Jian-Ming; Hu, Xiu-Rong
Comparison of the crystal structures of the potent anticancer and anti-angiogenic agent regorafenib and its monohydrate
Acta Crystallographica Section C, 2016, 72, 291-296
2020432 CIF
HKL
Paper
C18 H20 N2 O6 S2P 1 21/n 115.722; 6.1383; 19.5185
90; 94.954; 90
1876.6Gaytán-Barrientos, Nancy Sarahy; Morales-Morales, David; Herrera-Ruiz, Dea; Reyes-Martínez, Reyna; Rivera-Islas, Jesús
Sulfonate salts of the therapeutic agent dapsone: 4-[(4-aminophenyl)sulfonyl]anilinium benzenesulfonate monohydrate and 4-[(4-aminophenyl)sulfonyl]anilinium methanesulfonate monohydrate
Acta Crystallographica Section C, 2016, 72, 280-284
2020433 CIF
HKL
C13 H18 N2 O6 S2P 1 21/n 115.9355; 6.0062; 17.1547
90; 97.222; 90
1628.88Gaytán-Barrientos, Nancy Sarahy; Morales-Morales, David; Herrera-Ruiz, Dea; Reyes-Martínez, Reyna; Rivera-Islas, Jesús
Sulfonate salts of the therapeutic agent dapsone: 4-[(4-aminophenyl)sulfonyl]anilinium benzenesulfonate monohydrate and 4-[(4-aminophenyl)sulfonyl]anilinium methanesulfonate monohydrate
Acta Crystallographica Section C, 2016, 72, 280-284
2020434 CIF
HKL
Paper
C36 H36 N16 Ni2 O14 S2P -19.4131; 9.9334; 13.0829
77.65; 83.824; 70.284
1124.11Wu, Xiang-Wen; Yin, Shi; Wu, Wan-Fu; Ma, Jian-Ping
Synthesis and characterization of two novel bimetallic macrocyclic complexes generated from 1,2,4-triazole-containing semi-rigid ligands and <i>M</i>(NO~3~)~2~ units (<i>M</i> = Ni and Zn)
Acta Crystallographica Section C, 2016, 72, 285-290
2020435 CIF
HKL
Paper
C36 H36 N16 O14 S2 Zn2P -110.0414; 14.4893; 15.6001
88.257; 81.614; 80.184
2212.53Wu, Xiang-Wen; Yin, Shi; Wu, Wan-Fu; Ma, Jian-Ping
Synthesis and characterization of two novel bimetallic macrocyclic complexes generated from 1,2,4-triazole-containing semi-rigid ligands and <i>M</i>(NO~3~)~2~ units (<i>M</i> = Ni and Zn)
Acta Crystallographica Section C, 2016, 72, 285-290
2020436 CIF
HKL
Paper
C24 H12 B Cl N6P n m a12.0347; 14.806; 10.2883
90; 90; 90
1833.2Virdo, Jessica D.; Lough, Alan J.; Bender, Timothy P.
Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation
Acta Crystallographica Section C, 2016, 72, 297-307
2020437 CIF
HKL
Paper
C24 H12 B Cl N6P n m a12.0156; 14.8099; 10.242
90; 90; 90
1822.6Virdo, Jessica D.; Lough, Alan J.; Bender, Timothy P.
Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation
Acta Crystallographica Section C, 2016, 72, 297-307
2020438 CIF
HKL
Paper
C24 H12 B Cl N6P n m a11.9993; 14.7761; 10.242
90; 90; 90
1815.9Virdo, Jessica D.; Lough, Alan J.; Bender, Timothy P.
Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation
Acta Crystallographica Section C, 2016, 72, 297-307
2020439 CIF
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C24 H12 B Cl N6P n m a12.0187; 14.798; 10.2632
90; 90; 90
1825.3Virdo, Jessica D.; Lough, Alan J.; Bender, Timothy P.
Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation
Acta Crystallographica Section C, 2016, 72, 297-307
2020440 CIF
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Paper
C24 H12 B Cl N6P n m a12.0634; 14.8634; 10.3901
90; 90; 90
1863Virdo, Jessica D.; Lough, Alan J.; Bender, Timothy P.
Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation
Acta Crystallographica Section C, 2016, 72, 297-307
2020441 CIF
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Paper
C30 H28 N4 O6 SnP -110.1883; 12.9209; 23.0447
102.352; 95.2584; 104.153
2840.09Linden, Anthony; Basu Baul, Tushar S.
π‒π stacking motifs in dialkylbis{5-[(<i>E</i>)-2-aryldiazen-1-yl]-2-hydroxybenzoato}tin(IV) complexes
Acta Crystallographica Section C, 2016, 72, 313-325
2020442 CIF
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C78 H86 N8 O12 Sn2P -112.0462; 13.6264; 22.8143
102.267; 100.318; 91.6029
3591.71Linden, Anthony; Basu Baul, Tushar S.
π‒π stacking motifs in dialkylbis{5-[(<i>E</i>)-2-aryldiazen-1-yl]-2-hydroxybenzoato}tin(IV) complexes
Acta Crystallographica Section C, 2016, 72, 313-325
2020443 CIF
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Paper
C90 H128 Ca2 N12 O26 S4C 1 2 132.1; 10.56; 15.8
90; 110.7; 90
5010.1Cong, Hengjiang
Crystal structure and bonding analysis of the first dinuclear calcium(II)‒proton-pump inhibitor (PPI) `butterfly molecule': a combined microcrystal synchrotron and DFT study
Acta Crystallographica Section C, 2016, 72, 326-336
2020444 CIF
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C28 H38 Cl4 N16 O2 S4 ZnC 1 2/c 119.4354; 16.7556; 15.3266
90; 119.483; 90
4344.8Karthikeyan, Ammasai; Zeller, Matthias; Thomas Muthiah, Packianathan
Supramolecular hydrogen-bonding patterns in the organic‒inorganic hybrid compound bis(4-amino-5-chloro-2,6-dimethylpyrimidinium) tetrathiocyanatozinc(II)‒4-amino-5-chloro-2,6-dimethylpyrimidine‒water (1/2/2)
Acta Crystallographica Section C, 2016, 72, 337-340
2020445 CIF
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C12 H8 Cl I4 N OP 1 21/n 17.6227; 13.9464; 16.0161
90; 101.644; 90
1667.62Bartashevich, E. V.; Batalov, V. I.; Yushina, I. D.; Stash, A. I.; Chen, Y. S.
Nontypical iodine‒halogen bonds in the crystal structure of (3<i>E</i>)-8-chloro-3-iodomethylidene-2,3-dihydro-1,4-oxazino[2,3,4-<i>ij</i>]quinolin-4-ium triiodide
Acta Crystallographica Section C, 2016, 72, 341-345
2020446 CIF
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C14 H15 N3 OP 1 21/c 117.0839; 4.235; 16.2258
90; 94.047; 90
1171.01Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020447 CIF
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C18 H23 N3 O2P 1 21/c 111.4233; 7.3707; 20.4624
90; 93.561; 90
1719.56Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020448 CIF
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C16 H20 N4 OP b c a18.886; 7.9898; 19.335
90; 90; 90
2917.6Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020449 CIF
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C22 H24 N4 OP 1 21/c 112.2994; 9.1501; 16.171
90; 95.289; 90
1812.15Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020450 CIF
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C22 H22 N4P 1 21 17.7594; 8.5383; 13.4525
90; 100.483; 90
876.38Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020451 CIF
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C23 H24 N4P c c n15.083; 27.563; 8.8681
90; 90; 90
3686.8Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Six polycyclic pyrimidoazepine derivatives: syntheses, molecular structures and supramolecular assembly
Acta Crystallographica Section C, 2016, 72, 346-357
2020452 CIF
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Paper
C66 H48 Cu4 N12 O14P 1 21/c 111.898; 28.663; 8.343
90; 97.77; 90
2819.1Liu, Ya-Hui; Lu, Li-Ping; Zhu, Miao-Li; Su, Feng
A three-dimensional mixed-valence Cu^II^/Cu^I^ coordination polymer constructed from biphenyl-3,4',5-tricarboxylate and 1,4-bis(1<i>H</i>-imidazol-1-yl)benzene ligands
Acta Crystallographica Section C, 2016, 72, 358-362
2020464 CIF
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Paper
C40 H36 N2 O14 Zn2P c c a16.864; 11.067; 22.764
90; 90; 90
4248.5Liang, Feng-Lan; Ma, De-Yun; Qin, Liang
A hydrostable and twofold interpenetrating three-dimensional zinc‒organic framework with rob topology based on 4,4'-oxydibenzoate and 3,3'-dimethyl-4,4'-bipyridine ligands
Acta Crystallographica Section C, 2016, 72, 373-378
2020465 CIF
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C5 H6 N2 O3P -14.874; 7.663; 8.325
66.97; 88.09; 87.07
285.7Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020466 CIF
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C8 H11 N3 O5P 1 21/c 18.671; 12.394; 9.381
90; 90.17; 90
1008.2Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020467 CIF
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C7 H10 N2 O5 SP 1 21/n 16.9341; 6.9015; 20.919
90; 96.604; 90
994.5Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020468 CIF
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C9 H13 N3 O5P 1 21/n 111.7707; 6.1053; 15.271
90; 90.858; 90
1097.3Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020469 CIF
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C8 H11 N3 O4 SP 1 21/c 110.1742; 11.4616; 9.9715
90; 104.318; 90
1126.7Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020470 CIF
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C7 H10 N2 O4 S2P -17.0475; 8.9534; 9.2802
115.79; 95.753; 95.791
517.72Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020471 CIF
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C11 H16 N2 O6 SP -15.2819; 10.3542; 13.0071
89.377; 85.143; 77.7
692.51Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020472 CIF
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C5 H4 N2 O3 SP 1 21/c 111.409; 15.552; 7.369
90; 97.599; 90
1296Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020473 CIF
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C22 H21 N OP 1 21/c 124.8049; 10.7126; 12.1932
90; 95.929; 90
3222.7Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020474 CIF
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C22 H21 N OP 21 21 217.5541; 14.7914; 15.4049
90; 90; 90
1721.28Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020475 CIF
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C22 H21 N OP 1 21 17.2201; 7.8128; 14.7409
90; 93.69; 90
829.8Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020476 CIF
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C18 H18 F N OP b c a7.5932; 7.5859; 51.01
90; 90; 90
2938.2Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020477 CIF
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C15 H20 F N OR -3 :H25.119; 25.119; 11.2812
90; 90; 120
6164.4Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020478 CIF
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C15 H20 F N OR -3 :H49.395; 49.395; 11.1802
90; 90; 120
23623.6Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020479 CIF
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Paper
C36 H30 Cd N6 O7P -19.9863; 10.3722; 15.7502
91.755; 99.029; 95.042
1603.32Zhang, Zhi-Liang; Liu, Jia-Cheng
A new one-dimensional cadmium(II) coordination polymer incorporating 4-[4-(1<i>H</i>-imidazol-1-yl)phenyl]pyridine and 5-hydroxybenzene-1,3-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72, 389-392
2020480 CIF
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C16 H17 N3 O6P 1 21/c 113.0087; 7.2092; 17.0024
90; 101.297; 90
1563.6Badour, Alec R.; Wisniewski, John A.; Mohanty, Dillip K.; Squattrito, Philip J.
Two <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2016, 72, 405-410
2020481 CIF
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C16 H16 N2 O6 SC 1 2 121.26; 5.7264; 14.2762
90; 103.456; 90
1690.3Badour, Alec R.; Wisniewski, John A.; Mohanty, Dillip K.; Squattrito, Philip J.
Two <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2016, 72, 405-410
2020482 CIF
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Paper
C19 H32 O5P 21 21 216.9028; 11.0334; 24.451
90; 90; 90
1862.2Faroque, Muhammad Umer; Yousuf, Sammer; Zafar, Salman; Choudhary, M. Iqbal; Ahmed, Maqsood
Transferred multipolar atom model for 10β,17β-dihydroxy-17α-methylestr-4-en-3-one dihydrate obtained from the biotransformation of methyloestrenolone
Acta Crystallographica Section C, 2016, 72, 398-404
2020483 CIF
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C29 H41 Cl N2 Ni O8 P2P b c a11.7012; 16.2076; 35.285
90; 90; 90
6691.7García-Eleno, Marco A.; Quezada-Miriel, Magdalena; Reyes-Martínez, Reyna; Hernández-Ortega, Simón; Morales-Morales, David
A comparative study of the packing of two polymorphs of the nickel(II) pincer complex [2,6-bis(di-<i>tert</i>-butylphosphinoyl)-4-(3,5-dinitrobenzoyloxy)phenyl-κ^3^<i>P</i>,<i>C</i>^1^,<i>P</i>']chloridonickel(II)
Acta Crystallographica Section C, 2016, 72, 393-397
2020484 CIF
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C29 H41 Cl N2 Ni O8 P2C 1 c 110.9248; 21.5339; 15.071
90; 101.851; 90
3469.9García-Eleno, Marco A.; Quezada-Miriel, Magdalena; Reyes-Martínez, Reyna; Hernández-Ortega, Simón; Morales-Morales, David
A comparative study of the packing of two polymorphs of the nickel(II) pincer complex [2,6-bis(di-<i>tert</i>-butylphosphinoyl)-4-(3,5-dinitrobenzoyloxy)phenyl-κ^3^<i>P</i>,<i>C</i>^1^,<i>P</i>']chloridonickel(II)
Acta Crystallographica Section C, 2016, 72, 393-397
2020485 CIF
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C10 H9 N O S2P 1 21/n 18.4228; 7.9082; 16.2102
90; 97.152; 90
1071.35Balti, Monaem; Norberg, Bernadette; Efrit, Mohamed Lotfi; Lanners, Steve; Wouters, Johan
Conformation and tautomerism of methoxy-substituted 4-phenyl-4-thiazoline-2-thiones: a combined crystallographic and <i>ab initio</i> investigation
Acta Crystallographica Section C, 2016, 72, 421-425
2020486 CIF
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C10 H9 N O S2P 1 21/n 14.7187; 12.0438; 17.8972
90; 93.752; 90
1014.94Balti, Monaem; Norberg, Bernadette; Efrit, Mohamed Lotfi; Lanners, Steve; Wouters, Johan
Conformation and tautomerism of methoxy-substituted 4-phenyl-4-thiazoline-2-thiones: a combined crystallographic and <i>ab initio</i> investigation
Acta Crystallographica Section C, 2016, 72, 421-425
2020487 CIF
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Paper
C83 H109 O5 P3 S6 Si6 V2C 1 2/c 118.474; 25.4633; 19.3663
90; 100.036; 90
8970.7Wu, Hong-Ming; Chang, Ya-Ho; Su, Chia-Lin; Lee, Gene-Hsiang; Hsu, Hua-Fen
A non-oxo methanolate-bridged divanadium(IV) complex with tris(2-sulfanidylphenyl)phosphane ligands: synthesis, structural characterization and magnetic investigation
Acta Crystallographica Section C, 2016, 72, 416-420
2020488 CIF
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Paper
C28 H40 Br2 Cd3 Cl4 N4 O4P -18.1048; 10.3928; 11.574
100.957; 96.178; 99.694
933.59Yahsi, Yasemin; Ozbek, Hatice; Aygun, Muhittin; Kara, Hulya
Crystal structure and photoluminescence properties of a new Cd^II^ coordination polymer <i>catena</i>-poly[bis[4-bromo-2-({[2-(pyrrolidin-1-yl)ethyl]imino}methyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]di-μ~3~-chlorido-di-μ~2~-chlorido-bis(methanol-κ<i>O</i>)tricadmium(II)]
Acta Crystallographica Section C, 2016, 72, 426-431
2020489 CIF
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Paper
C5 H27 Al N2 O18 S2P -16.667; 12.16; 12.911
72.3; 81.03; 85.57
984.5Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020490 CIF
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C10 H54 Co3 N4 O36 S4P -16.64; 11.71; 14.294
67.97; 81.57; 85.39
1018.8Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020491 CIF
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C10 H54 Mg3 N4 O36 S4P -16.682; 11.807; 14.309
68.23; 82.13; 84.76
1037.5Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020492 CIF
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C10 H26 N4 Ni O14 S2P -16.97; 7.913; 11.391
72.31; 89.57; 64.2
533.2Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020493 CIF
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C10 H26 N4 O14 S2 ZnP -16.977; 7.929; 11.441
72.25; 89.53; 64.45
538.2Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020494 CIF
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Paper
C70 H46 Co2 N6 O10P -19.71; 10.891; 15.546
77.129; 74.474; 65.034
1425Liu, Runqiang; Zhao, Ning; Liu, Ping; An, Caixia; Lian, Zhaoxun
Enhanced third-order nonlinear optical properties determined in thin films using the Z-scan technique: bis(μ-4,4'-oxydibenzoato)bis[(4'-phenyl-2,2':6',2''-terpyridine)cobalt(II)]
Acta Crystallographica Section C, 2016, 72, 451-455
2020495 CIF
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Paper
C48 H22 F18 P2 Pt S2P -110.3553; 10.5983; 12.4594
114.574; 104.4; 99.442
1147.61Bernès, Sylvain; Meléndez, Francisco J.; Torrens, Hugo
<i>Cis</i>‒<i>trans</i> isomerism in a square-planar platinum(II) complex bearing bulky fluorinated phosphane ligands
Acta Crystallographica Section C, 2016, 72, 268-273
2020496 CIF
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Paper
C48 H22 F18 P2 Pt S2P b c a20.348; 19.511; 22.6059
90; 90; 90
8974.8Bernès, Sylvain; Meléndez, Francisco J.; Torrens, Hugo
<i>Cis</i>‒<i>trans</i> isomerism in a square-planar platinum(II) complex bearing bulky fluorinated phosphane ligands
Acta Crystallographica Section C, 2016, 72, 268-273
2020497 CIF
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Paper
C22 H30 N2 O11 Zn2P -19.2372; 9.7244; 14.511
79.099; 83.298; 75.012
1233.2Liu, Yang; Feng, Yong-Lan; Fu, Wei-Wei
A two-dimensional zinc(II) coordination polymer based on mixed dimethyl succinate and bipyridine ligands: synthesis, structure, thermostability and luminescence properties
Acta Crystallographica Section C, 2016, 72, 308-312
2020498 CIF
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Paper
C17 H20 N4 O5C 1 2/c 136.5539; 6.0781; 16.5167
90; 102.228; 90
3586.4Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.
Carboxylate‒phenolate tautomerism in 5-[(nitrophenyl)diazenyl]salicylate anions
Acta Crystallographica Section C, 2016, 72, 274-279
2020499 CIF
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Paper
C17 H20 N4 O5P 1 21/c 113.4305; 6.782; 19.4498
90; 92.935; 90
1769.27Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.
Carboxylate‒phenolate tautomerism in 5-[(nitrophenyl)diazenyl]salicylate anions
Acta Crystallographica Section C, 2016, 72, 274-279
2020501 CIF
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Paper
C17 H29 I2 N5P -15.2513; 13.9534; 16.0336
101.766; 93.23; 99.0746
1130.99Cebollada, Andrea; Vellé, Alba; Sanz Miguel, Pablo J.
Hirshfeld and DFT analysis of the N-heterocyclic carbene proligand methylenebis(N-butylimidazolium) as the acetonitrile-solvated diiodide salt
Acta Crystallographica Section C Structural Chemistry, 2016, 72
2020502 CIF
HKL
C10 H16 N5 O8 PP 21 21 217.715; 10.598; 35.481
90; 90; 90
2901.1Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020503 CIF
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C10 H12.6 N5 O6.3 PP 21 21 217.786; 10.638; 29.887
90; 90; 90
2475.5Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020504 CIF
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C10 H22 N5 O12 PP 21 21 216.691; 13.555; 19.863
90; 90; 90
1801.5Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020505 CIF
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C10 H19 N5 Na O11 PP 21 21 217.206; 12.669; 18.754
90; 90; 90
1712.1Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020506 CIF
HKL
C10 H18 N4 Na O11 PP 21 21 216.652; 14.726; 17.208
90; 90; 90
1685.7Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020507 CIF
HKL
Paper
C6 H9 N3 OP -16.613; 7.018; 7.078
97.374; 104.521; 92.038
314.6Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
Two tautomeric forms of 2-amino-5,6-dimethylpyrimidin-4-one
Acta Crystallographica Section C, 2016, 72
2020508 CIF
HKL
Paper
C6 H9 N3 OP 1 21/c 17.188; 28.047; 13.3265
90; 101.414; 90
2633.5Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
Two tautomeric forms of 2-amino-5,6-dimethylpyrimidin-4-one
Acta Crystallographica Section C, 2016, 72
2020514 CIF
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C22 H21 Cd N5 O5P -18.5502; 9.2713; 15.363
88.48; 83.73; 76.65
1177.8Huang, Qiu-Ying; Lin, Xiao-Yi; Meng, Xiang-Ru
A new one-dimensional Cd^II^ coordination polymer with a two-dimensional layered structure incorporating 2-[(1<i>H</i>-imidazol-1-yl)methyl]-1<i>H</i>-benzimidazole and benzene-1,2-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72
2020515 CIF
Paper
C30 H52 O4C 1 2 123.908; 7.4853; 15.363
90; 91.89; 90
2747.8Xu, Yang-Rong; Yang, Jing-Jing; Liu, Juan; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of C24-epimeric 20(<i>R</i>)-ocotillol-type saponins
Acta Crystallographica Section C, 2016, 72
2020516 CIF
Paper
C30 H54 O5P 1 21 16.8503; 29.1839; 14.8014
90; 102.7; 90
2886.7Xu, Yang-Rong; Yang, Jing-Jing; Liu, Juan; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of C24-epimeric 20(<i>R</i>)-ocotillol-type saponins
Acta Crystallographica Section C, 2016, 72
2020517 CIF
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Paper
C60 H72 Cl6 Co N12 O4P -18.909; 13.332; 14.92
93.598; 99.037; 104.678
1683.2Zhang, Yao; Li, Jie; Ren, Guoyu; Qin, Baofu; Ma, Haixia
Synthesis, crystal structure and antifungal activity of a divalent cobalt(II) complex with uniconazole
Acta Crystallographica Section C, 2016, 72
2020518 CIF
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Paper
C26 H32 Cl2 N6 O2 ZnP -111.2504; 11.7298; 12.6588
71.518; 71.087; 65.76
1407.9DeStefano, Matthew R.; Geiger, David K.
Structural and spectroscopic characterization of two new blue luminescent pyridylbenzimidazole zinc(II) complexes
Acta Crystallographica Section C, 2016, 72
2020519 CIF
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Paper
C26 H30 N4 O5 ZnP 1 21/n 116.0866; 8.715; 18.745
90; 94.193; 90
2620.9DeStefano, Matthew R.; Geiger, David K.
Structural and spectroscopic characterization of two new blue luminescent pyridylbenzimidazole zinc(II) complexes
Acta Crystallographica Section C, 2016, 72
2020521 CIF
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Paper
C38 H33 B N O P2 RhP 1 21/c 113.9227; 12.35; 19.7966
90; 105.987; 90
3272.28Galding, M. R.; Virovets, A. V.; Kazakov, I. V.; Scheer, M.; Smirnov, S. N.; Timoshkin, A. Y.
Diminished electron density in the Vaska-type rhodium(I) complex <i>trans</i>-[Rh(NCBH~3~)(CO)(PPh~3~)~2~]
Acta Crystallographica Section C, 2016, 72, 514-517
2020522 CIF
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Paper
C11 H13 N OP 1 21 16.2155; 8.7681; 8.9686
90; 106.14; 90
469.51Donkeng Dazie, Joel; Liška, Alan; Ludvík, Jiří; Fábry, Jan; Dušek, Michal
A study of the planarity of the pyrrolone fragment in 2-isopropyl-2,3-dihydro-1<i>H</i>-isoindol-1-one
Acta Crystallographica Section C, 2016, 72, 518-524
2020525 CIF
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Paper
C18 H23 Cl2 Cu1.5 N6 O4C 1 2/c 118.5958; 16.6608; 14.2394
90; 93.692; 90
4402.5Bergamini, F. R. G.; Ribeiro, M. A.; Miranda, P. C. M. L.; Formiga, A. L. B.; Corbi, P. P.
A novel binuclear copper complex incorporating a nalidixic acid derivative displaying a one-dimensional coordination polymeric structure
Acta Crystallographica Section C, 2016, 72, 544-548
2020526 CIF
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C18 H16 N5 O5.5 ZnC 1 2/c 121.612; 10.421; 19.246
90; 116.85; 90
3867.3Jian, Shou-Jun; Han, Qian-Qian; Yang, Huai-Xia; Meng, Xiang-Ru
A new three-dimensional zinc(II) coordination polymer involving 2-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72, 530-535
2020527 CIF
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Paper
C28 H20 N4 O4 Pb2P -18.3754; 12.6354; 13.6686
112.213; 101.395; 95.781
1287.99Schwade, Vânia Denise; Faoro, Eliandro; Schulz Lang, Ernesto
Intermolecular Pb···N interactions in lead(II) dimers producing a supramolecular two-dimensional metal‒organic compound: bis[μ~2~-<i>N</i>'-(2-oxidobenzylidene)benzohydrazidato-κ^4^<i>O</i>:<i>O</i>,<i>N</i>',<i>O</i>']dilead(II)
Acta Crystallographica Section C, 2016, 72, 525-529
2020528 CIF
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Paper
C9 H20 N2 O4 S4P 19.489; 9.8774; 15.079
71.429; 75.65; 89.369
1294.4Görbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Grønnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, Bård Edgar Vestheim
A phase transition from monoclinic <i>C</i>2 with <i>Z</i>' = 1 to triclinic <i>P</i>1 with <i>Z</i>' = 4 for the quasiracemate <small>L</small>-2-aminobutyric acid‒<small>D</small>-methionine (1/1)
Acta Crystallographica Section C, 2016, 72, 536-543
2020529 CIF
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Paper
C9 H20 N2 O4 SC 1 2 129.1721; 4.7784; 9.8551
90; 103.145; 90
1337.77Görbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Grønnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, Bård Edgar Vestheim
A phase transition from monoclinic <i>C</i>2 with <i>Z</i>' = 1 to triclinic <i>P</i>1 with <i>Z</i>' = 4 for the quasiracemate <small>L</small>-2-aminobutyric acid‒<small>D</small>-methionine (1/1)
Acta Crystallographica Section C, 2016, 72, 536-543
2020530 CIF
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Paper
C17 H16 N2 O4 SP 21 21 215.4764; 15.9117; 18.3228
90; 90; 90
1596.63Ukrainets, Igor V.; Shishkina, Svitlana V.; Baumer, Vyacheslav N.; Gorokhova, Olga V.; Petrushova, Lidiya A.; Sim, Galina
Two pseudo-enantiomeric forms of <i>N</i>-benzyl-4-hydroxy-1-methyl-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide and their analgesic properties
Acta Crystallographica Section C, 2016, 72, 411-415
2020531 CIF
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Paper
C17 H16 N2 O4 SP 21 21 215.4469; 15.8455; 18.2412
90; 90; 90
1574.38Ukrainets, Igor V.; Shishkina, Svitlana V.; Baumer, Vyacheslav N.; Gorokhova, Olga V.; Petrushova, Lidiya A.; Sim, Galina
Two pseudo-enantiomeric forms of <i>N</i>-benzyl-4-hydroxy-1-methyl-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide and their analgesic properties
Acta Crystallographica Section C, 2016, 72, 411-415
2020532 CIF
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Paper
C11 H16 Cl Co N3 O6 SP -17.2407; 7.9326; 15.055
92.932; 102.406; 102.727
819.37Karthikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in Co^II^ and Cu^II^ complexes with thiophene-2-carboxylate and 2-amino-4,6-dimethoxypyrimidine ligands
Acta Crystallographica Section C, 2016, 72, 442-450
2020533 CIF
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Paper
C26 H21 Cu2 N3 O10 S4C 1 2/c 118.5881; 10.1091; 17.5284
90; 111.847; 90
3057.19Karthikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in Co^II^ and Cu^II^ complexes with thiophene-2-carboxylate and 2-amino-4,6-dimethoxypyrimidine ligands
Acta Crystallographica Section C, 2016, 72, 442-450
2020534 CIF
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Paper
C7 H5 N O4P 1 21/c 13.9356; 7.2005; 25.41
90; 90.578; 90
720.04Ibragimov, Aziz; Ashurov, Jamshid; Ibragimov, Bakhtiyar; Wang, Ai; Mouhib, Halima; Englert, Ulli
Conformational dimorphism in <i>o</i>-nitrobenzoic acid: alternative ways to avoid the O···O clash
Acta Crystallographica Section C, 2016, 72, 566-571
2020535 CIF
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B Ge2 Li4R 3 m :H4.4603; 4.4603; 18.3197
90; 90; 120
315.63Pavlyuk, Volodymyr; Ciesielski, Wojciech; Rozdzynska-Kielbik, Beata; Dmytriv, Grygoriy; Ehrenberg, Helmut
Li~4~Ge~2~B as a new derivative of the Mo~2~B~5~ and Li~5~Sn~2~ structure types
Acta Crystallographica Section C, 2016, 72, 561-565
2020536 CIF
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Paper
C17 H18 N2 OP -15.6051; 8.6411; 14.3853
86.192; 81.237; 87.313
686.61Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Diastereoisomeric forms of 11-ethyl-6,11-dihydro-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>]azepine-6-carboxamide: syntheses and the molecular and supramolecular structure of the minor form (6<i>RS</i>,11<i>RS</i>)-11-ethyl-6,11-dihydro-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>]azepine-6-carboxamide
Acta Crystallographica Section C, 2016, 72, 549-554
2020538 CIF
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C29 H20 Ag2 N5 O4 S4P 1 21/n 115.3542; 7.9565; 24.8986
90; 98.477; 90
3008.52Dennehy, Mariana; Delgado, Fermín; Freire, Eleonora; Halac, Emilia; Baggio, Ricardo
A polymeric silver thiosaccarinate complex with a two-dimensional triply entangled mesh and argentophilic interactions
Acta Crystallographica Section C, 2016, 72, 572-577
2020539 CIF
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Paper
C92 H86 Eu2 O16P 1 21/c 112.0922; 13.9102; 23.1235
90; 95.51; 90
3871.5Minyaev, Mikhail E.; Vinogradov, Alexandr A.; Roitershtein, Dmitrii M.; Lyssenko, Konstantin A.; Ananyev, Ivan V.; Nifant'ev, Ilya E.
Di- and triphenylacetate complexes of yttrium and europium
Acta Crystallographica Section C, 2016, 72, 578-584
2020540 CIF
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Paper
C92 H86 O16 Y2P 1 21/c 111.4292; 21.371; 16.335
90; 102.37; 90
3897.3Minyaev, Mikhail E.; Vinogradov, Alexandr A.; Roitershtein, Dmitrii M.; Lyssenko, Konstantin A.; Ananyev, Ivan V.; Nifant'ev, Ilya E.
Di- and triphenylacetate complexes of yttrium and europium
Acta Crystallographica Section C, 2016, 72, 578-584
2020541 CIF
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Paper
C66 H69 Eu O12P -113.3716; 13.5971; 17.7021
93.0794; 92.9949; 118.475
2813.9Minyaev, Mikhail E.; Vinogradov, Alexandr A.; Roitershtein, Dmitrii M.; Lyssenko, Konstantin A.; Ananyev, Ivan V.; Nifant'ev, Ilya E.
Di- and triphenylacetate complexes of yttrium and europium
Acta Crystallographica Section C, 2016, 72, 578-584
2020542 CIF
Paper
C20 H20 Br2 Cu2 N2 O4P 1 21/n 19.0043; 10.2212; 22.7814
90; 92.085; 90
2095.29Yahsi, Yasemin
X-ray characterization and magnetic properties of dioxygen-bridged Cu^II^ and Mn^III^ Schiff base complexes
Acta Crystallographica Section C, 2016, 72, 585-592
2020543 CIF
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C76 H88 Cl12 Mn4 N8 O32P 1 21/n 114.126; 19.394; 17.02
90; 91.66; 90
4660.8Yahsi, Yasemin
X-ray characterization and magnetic properties of dioxygen-bridged Cu^II^ and Mn^III^ Schiff base complexes
Acta Crystallographica Section C, 2016, 72, 585-592
2020544 CIF
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Paper
C9 H6 F2 O2P 1 21/c 13.8856; 19.292; 10.9859
90; 92.221; 90
822.9Galica, Tomasz; Bakowicz, Julia; Broda, Piotr; Turowska-Tyrk, Ilona
Monitoring photo-induced transformations in crystals of 2,6-difluorocinnamic acid under ambient conditions
Acta Crystallographica Section C, 2016, 72, 593-599
2020545 CIF
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Paper
C9 H6 F2 O2P 1 21/c 13.886; 19.185; 11.1567
90; 92.873; 90
830.7Galica, Tomasz; Bakowicz, Julia; Broda, Piotr; Turowska-Tyrk, Ilona
Monitoring photo-induced transformations in crystals of 2,6-difluorocinnamic acid under ambient conditions
Acta Crystallographica Section C, 2016, 72, 593-599
2020546 CIF
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Paper
C21.5 H16 F4 O4P -17.6212; 10.3137; 13.1849
112.145; 96.843; 97.96
933.94Galica, Tomasz; Bakowicz, Julia; Broda, Piotr; Turowska-Tyrk, Ilona
Monitoring photo-induced transformations in crystals of 2,6-difluorocinnamic acid under ambient conditions
Acta Crystallographica Section C, 2016, 72, 593-599
2020547 CIF
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Paper
C42 H44 Cu2 N10 Ni O6 S2P 1 21/c 119.196; 10.2943; 22.347
90; 97.998; 90
4373Hopa, Cigdem; Cokay, Ismail
Designing a heterotrinuclear CuII—NiII—CuIIcomplex from a mononuclear CuIISchiff base precursor with dicyanamide as a coligand: synthesis, crystal structure, thermal and photoluminescence properties
Acta Crystallographica Section C Structural Chemistry, 2016, 72
2020549 CIFC19 H23 N O4P -17.432; 9.962; 11.373
85.63; 85.34; 81.32
827.9Turgunov, Kambarali K.; Zhurakulov, Sherzod N.; Englert, Ulli; Vinogradova, Valentina I.; Tashkhodjaev, Bakhodir
Synthesis of 2-(2-hydroxyethyl)-1-(2-hydroxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline and pseudosymmetry in its crystal structure
Acta Crystallographica Section C, 2016, 72
2020550 CIF
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Paper
C19 H23 N O4P -17.429; 14.535; 15.675
97.575; 98.902; 92.28
1654.5Turgunov, Kambarali K.; Zhurakulov, Sherzod N.; Englert, Ulli; Vinogradova, Valentina I.; Tashkhodjaev, Bakhodir
Synthesis of 2-(2-hydroxyethyl)-1-(2-hydroxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline and pseudosymmetry in its crystal structure
Acta Crystallographica Section C, 2016, 72
2020551 CIF
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Paper
C15 H10 F N5 O7P 1 21/c 111.8062; 8.0061; 17.6442
90; 107.009; 90
1594.81Girisha, Marisiddaiah; Yathirajan, Hemmige S.; Jasinski, Jerry P.; Glidewell, Christopher
Different acid‒base behaviour of a pyrazole and an isoxazole with organic acids: crystal and molecular structures of the salt 3-(4-fluorophenyl)-1<i>H</i>-pyrazolium 2,4,6-trinitrophenolate and of the cocrystal 4-amino-<i>N</i>-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide‒3,5-dinitrobenzoic acid (1/1)
Acta Crystallographica Section C, 2016, 72
2020552 CIF
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Paper
C18 H17 N5 O9 SP -17.8189; 8.6727; 15.9304
96.439; 94.458; 107.477
1016.79Girisha, Marisiddaiah; Yathirajan, Hemmige S.; Jasinski, Jerry P.; Glidewell, Christopher
Different acid‒base behaviour of a pyrazole and an isoxazole with organic acids: crystal and molecular structures of the salt 3-(4-fluorophenyl)-1<i>H</i>-pyrazolium 2,4,6-trinitrophenolate and of the cocrystal 4-amino-<i>N</i>-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide‒3,5-dinitrobenzoic acid (1/1)
Acta Crystallographica Section C, 2016, 72
2020553 CIF
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Paper
C23 H21 N O3P 1 21/c 19.0386; 8.2036; 25.119
90; 96.385; 90
1851Luque, Adriana L.; Sanabria, Carlos M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Unexpected ring-closure products derived from 3-(2-allylanilino)-3-phenylacrylate esters: crystal and molecular structures of 3-acetyl-8-allyl-6-methyl-2-phenylquinolin-4-yl acetate and (2<i>RS</i>)-2,8-dimethyl-4-phenyl-1,2-dihydro-6<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinolin-6-one
Acta Crystallographica Section C, 2016, 72
2020554 CIF
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Paper
C19 H17 N OC 1 2/c 117.756; 10.364; 15.232
90; 92.774; 90
2799.8Luque, Adriana L.; Sanabria, Carlos M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Unexpected ring-closure products derived from 3-(2-allylanilino)-3-phenylacrylate esters: crystal and molecular structures of 3-acetyl-8-allyl-6-methyl-2-phenylquinolin-4-yl acetate and (2<i>RS</i>)-2,8-dimethyl-4-phenyl-1,2-dihydro-6<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinolin-6-one
Acta Crystallographica Section C, 2016, 72
2020555 CIF
HKL
Paper
O41 Sr7 Te12 V4P -17.1772; 9.9314; 14.4116
96.7621; 91.9467; 100.112
1002.69Kim, Sun Woo; Emge, Thomas J.; Greenblatt, Martha
A new one-dimensional strontium vanadium tellurite, Sr~7~V~4~Te~12~O~41~
Acta Crystallographica Section C, 2016, 72
2020556 CIF
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C19 H33 N11 O3 SP -17.9688; 11.2412; 14.6144
109.442; 92.075; 100.877
1205.4Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020557 CIF
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C9 H15 N3 O3 SP -17.2516; 8.9841; 10.736
109.275; 109.132; 97.283
601.7Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020558 CIF
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C10 H17 N3 O3 SP -18.209; 9.1804; 9.5617
65.128; 83.198; 78.854
640.9Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020559 CIF
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C8 H14 N2 O3 S2P 1 21/c 18.1891; 17.7131; 8.3032
90; 94.643; 90
1200.46Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020560 CIF
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C11 H17 N3 O3 SP -16.7673; 9.9189; 10.4097
82.868; 74.093; 74.741
647.3Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020561 CIF
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C10 H14 N6 O2 SP 1 21/c 14.6843; 13.9818; 19.5128
90; 91.45; 90
1277.6Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020562 CIF
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C16 H23 N9 O4 S2P 2 2 216.8086; 8.1414; 18.6651
90; 90; 90
1034.64Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
6-Propyl-2-thiouracil <i>versus</i> 6-methoxymethyl-2-thiouracil: enhancing the hydrogen-bonded synthon motif by replacement of a methylene group with an O atom
Acta Crystallographica Section C, 2016, 72
2020563 CIF
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Paper
C20 H12 Cu3 N6 O9P b c a23.095; 6.843; 26.222
90; 90; 90
4144.1Zhang, Li-Yang; Lu, Li-Ping; Feng, Si-Si
A two-dimensional mixed-valence Cu^II^/Cu^I^ coordination polymer constructed from 2-(pyridin-3-yl)-1<i>H</i>-imidazole-4,5-dicarboxylate
Acta Crystallographica Section C, 2016, 72
2020564 CIF
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Paper
C26 H30 N4 O8 Zn2C 1 2/c 110.059; 20.839; 13.198
90; 106.567; 90
2652Liu, Yang; Feng, Yong-Lan; Fu, Wei-Wei
Synthesis, structure, thermostability and luminescence properties of ZnIIand CdIIcoordination polymers based on dimethysuccinate and flexible 1,4-bis(imidazol-1-ylmethyl)benzene ligands
Acta Crystallographica Section C Structural Chemistry, 2016, 72
2020565 CIF
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C26 H30 Cd2 N4 O8C 1 2/c 110.575; 20.477; 13.938
90; 115.703; 90
2719.6Liu, Yang; Feng, Yong-Lan; Fu, Wei-Wei
Synthesis, structure, thermostability and luminescence properties of ZnIIand CdIIcoordination polymers based on dimethysuccinate and flexible 1,4-bis(imidazol-1-ylmethyl)benzene ligands
Acta Crystallographica Section C Structural Chemistry, 2016, 72
2020566 CIF
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Paper
C17 H14 Cl N3P b c a14.73; 12.413; 16.464
90; 90; 90
3010Kumara, Tholappanavara H. Suresha; Nagendrappa, Gopalpur; Chandrika, Nanjappa; Sowmya, Haliwana B. V.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Reactions between arylhydrazinium chlorides and 2-chloroquinoline-3-carbaldehydes: molecular and supramolecular structures of a hydrazone, a 4,9-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinoline and two 1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolines
Acta Crystallographica Section C, 2016, 72
2020567 CIF
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Paper
C17 H15 N3P 1 21/n 16.6676; 26.571; 7.912
90; 104.561; 90
1356.7Kumara, Tholappanavara H. Suresha; Nagendrappa, Gopalpur; Chandrika, Nanjappa; Sowmya, Haliwana B. V.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Reactions between arylhydrazinium chlorides and 2-chloroquinoline-3-carbaldehydes: molecular and supramolecular structures of a hydrazone, a 4,9-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinoline and two 1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolines
Acta Crystallographica Section C, 2016, 72
2020568 CIF
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Paper
C16 H11 N3P b c n25.145; 16.9623; 16.8138
90; 90; 90
7171.4Kumara, Tholappanavara H. Suresha; Nagendrappa, Gopalpur; Chandrika, Nanjappa; Sowmya, Haliwana B. V.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Reactions between arylhydrazinium chlorides and 2-chloroquinoline-3-carbaldehydes: molecular and supramolecular structures of a hydrazone, a 4,9-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinoline and two 1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolines
Acta Crystallographica Section C, 2016, 72
2020569 CIF
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Paper
C17 H13 N3R -3 :H29.9202; 29.9202; 7.3811
90; 90; 120
5722.4Kumara, Tholappanavara H. Suresha; Nagendrappa, Gopalpur; Chandrika, Nanjappa; Sowmya, Haliwana B. V.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Reactions between arylhydrazinium chlorides and 2-chloroquinoline-3-carbaldehydes: molecular and supramolecular structures of a hydrazone, a 4,9-dihydro-1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinoline and two 1<i>H</i>-pyrazolo[3,4-<i>b</i>]quinolines
Acta Crystallographica Section C, 2016, 72
2020570 CIF
HKL
Paper
C19 H18 Cl N3 O2P -110.1018; 10.6099; 18.8129
100.292; 91.881; 116.873
1754.78Narayana, Badiadka; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Different molecular conformations co-exist in each of three 2-aryl-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)acetamides: hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2016, 72
2020571 CIF
HKL
Paper
C19 H18 Cl N3 O2C 1 2/c 123.023; 8.2976; 21.602
90; 120.957; 90
3538.9Narayana, Badiadka; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Different molecular conformations co-exist in each of three 2-aryl-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)acetamides: hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2016, 72
2020572 CIF
HKL
Paper
C22 H40 N4P -15.299; 9.072; 10.604
92.3; 90.1; 99.61
502.18Moon, Dohyun; Hong, Yong Pyo; Choi, Jong-Ha
Spectroscopic characterization and molecular structure of 3,14-dimethyl-2,6,13,17-tetraazapentacyclo[16.4.0.1^2,17^.1^6,13^.0^7,12^]tetracosane
Acta Crystallographica Section C, 2016, 72
2020573 CIF
HKL
Paper
C13 H10 F2 N2 OC 1 2/c 120.6614; 12.6052; 9.1691
90; 109.284; 90
2254Capacci-Daniel, Christina A.; Bertke, Jeffery A.; Dehghan, Shoaleh; Hiremath-Darji, Rupa; Swift, Jennifer A.
Concomitant polymorphs of 1,3-bis(3-fluorophenyl)urea
Acta Crystallographica Section C, 2016, 72
2020574 CIF
HKL
C13 H10 F2 N2 OP n a 2123.5797; 10.1792; 4.6031
90; 90; 90
1104.85Capacci-Daniel, Christina A.; Bertke, Jeffery A.; Dehghan, Shoaleh; Hiremath-Darji, Rupa; Swift, Jennifer A.
Concomitant polymorphs of 1,3-bis(3-fluorophenyl)urea
Acta Crystallographica Section C, 2016, 72
2020575 CIF
HKL
C4 H6 N4P 1 21/c 112.033; 4.0256; 11.5992
90; 118.346; 90
494.5Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020576 CIF
HKL
C6 H10 N4 OP 1 21/c 17.6282; 7.2157; 13.879
90; 102.243; 90
746.6Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020577 CIF
HKL
C8 H15 N5 OP -18.0055; 8.0256; 9.3143
81.779; 78.053; 62.518
518.63Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020578 CIF
HKL
C9 H15 N5 OP 1 21/n 17.387; 24.8978; 11.5485
90; 98.824; 90
2098.9Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020579 CIF
HKL
C8 H10 N6 O3P 1 21/c 14.6822; 15.948; 13.514
90; 90.24; 90
1009.1Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020580 CIF
HKL
C14 H24 N8 O4 SP 1 21/n 18.0115; 19.2213; 12.9531
90; 90.23; 90
1994.7Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020581 CIF
HKL
C16 H28 N8 O4 SP 1 21/n 19.8868; 17.238; 12.8571
90; 88.151; 90
2190.1Hützler, Wilhelm Maximilian; Egert, Ernst; Bolte, Michael
One barbiturate and two solvated thiobarbiturates containing the triply hydrogen-bonded <i>ADA</i>/<i>DAD</i> synthon, plus one ansolvate and three solvates of their coformer 2,4-diaminopyrimidine
Acta Crystallographica Section C, 2016, 72
2020582 CIF
HKL
Paper
C80 H60 Co4 N8 O8P 1 21/n 111.6762; 18.3463; 16.07
90; 100.105; 90
3389Wang, Yingying; Wen, Meixia; Gao, Zhongjun; Sheng, Ning
Crystal structure and magnetic properties of a linear tetranuclear Co^II^ cluster
Acta Crystallographica Section C, 2016, 72
2020583 CIF
HKL
C16 H20 Ca2 N4 O18 P4P 1 21/c 116.4384; 25.2929; 6.9599
90; 91.493; 90
2892.8Venkatramaiah, Nutalapati; Mendes, Ricardo F.; Silva, Artur M. S.; Tomé, João P. C.; Almeida Paz, Filipe A.
A ladder coordination polymer based on Ca^2+^ and (4,5-dicyano-1,2-phenylene)bis(phosphonic acid): crystal structure and solution-state NMR study
Acta Crystallographica Section C, 2016, 72
2020584 CIF
HKL
C25 H20 Co N3 O6P -19.995; 10.294; 10.796
108.73; 99.81; 94.99
1024.6Hasi, Qi-Meige; Fan, Yan; Hou, Chen; Yao, Xiao-Qiang; Liu, Jia-Cheng
Two new two-dimensional coordination polymers based on isophthalate and a flexible <i>N</i>-donor ligand containing benzimidazole and pyridine rings: synthesis, crystal structures and a solid-state UV‒Vis study
Acta Crystallographica Section C, 2016, 72, 724-729
2020585 CIF
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C25 H20 Cd N3 O6P -19.9608; 10.548; 11.1137
108.408; 99.712; 96.218
1075.6Hasi, Qi-Meige; Fan, Yan; Hou, Chen; Yao, Xiao-Qiang; Liu, Jia-Cheng
Two new two-dimensional coordination polymers based on isophthalate and a flexible <i>N</i>-donor ligand containing benzimidazole and pyridine rings: synthesis, crystal structures and a solid-state UV‒Vis study
Acta Crystallographica Section C, 2016, 72, 724-729
2020586 CIF
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Paper
C11 H17 N O2P 1 21/c 16.577; 9.5518; 17.8425
90; 96.026; 90
1114.71Vealey, Zachary N.; Mercado, Brandon Q.; Vaccaro, Patrick H.
The tropolone‒isobutylamine complex: a hydrogen-bonded troponoid without dominant π‒π interactions
Acta Crystallographica Section C, 2016, 72, 730-737
2020587 CIF
Paper
C22 H22 N2 O6P 1 21 18.529; 7.352; 15.075
90; 100.18; 90
930.4Ali, Md. Ashraf; Noguchi, Shuji; Watanabe, Miteki; Iwao, Yasunori; Itai, Shigeru
The antitumour drug 7-ethyl-10-hydroxycamptothecin monohydrate and its solid-state hydrolysis mechanism on heating
Acta Crystallographica Section C, 2016, 72, 743-747
2020588 CIF
HKL
Paper
C69 H66 N14 O20P -114.521; 15.5102; 15.6438
80.506; 88.951; 70.168
3266.3Lynch, Daniel E.; Smith, Graham; Keene, Tony D.; Horton, Peter N.
Crystal structure and hydrogen bonding in the hydrated cocrystalline salt tryptaminium‒3,5-dinitrobenzoate‒quinoline‒water (3/3/2/2)
Acta Crystallographica Section C, 2016, 72, 738-742
2020589 CIF
HKL
Paper
C20 H16 O2C 1 2/c 119.749; 7.284; 13.374
90; 125.89; 90
1558.6Bosch, Eric
Cocrystals of 1,4-diethynylbenzene with 1,3-diacetylbenzene and benzene-1,4-dicarbaldehyde exhibiting strong nonconventional alkyne‒carbonyl C—H···O hydrogen bonds between the components
Acta Crystallographica Section C, 2016, 72, 748-752
2020590 CIF
HKL
C18 H12 O2P 1 21/c 17.6207; 8.5205; 10.3361
90; 91.762; 90
670.83Bosch, Eric
Cocrystals of 1,4-diethynylbenzene with 1,3-diacetylbenzene and benzene-1,4-dicarbaldehyde exhibiting strong nonconventional alkyne‒carbonyl C—H···O hydrogen bonds between the components
Acta Crystallographica Section C, 2016, 72, 748-752
2020591 CIF
HKL
C17 H24 Cl N O5 PtP -18.3747; 10.5732; 11.0883
76.67; 89.496; 82.641
947.3Nguyen Thi Thanh, Chi; Pham Van, Thong; Le Thi Hong, Hai; Van Meervelt, Luc
Crystallization experiments with the dinuclear chelate ring complex di-μ-chlorido-bis[(η^2^-2-allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)platinum(II)]
Acta Crystallographica Section C, 2016, 72, 758-764
2020592 CIF
HKL
C16 H23 Cl O5 Pt SP -18.792; 12.1383; 17.4745
87.03; 82.074; 87.651
1843.5Nguyen Thi Thanh, Chi; Pham Van, Thong; Le Thi Hong, Hai; Van Meervelt, Luc
Crystallization experiments with the dinuclear chelate ring complex di-μ-chlorido-bis[(η^2^-2-allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)platinum(II)]
Acta Crystallographica Section C, 2016, 72, 758-764
2020593 CIF
HKL
C30 H38 Cl2 O8 Pt2P 1 21/n 113.56; 7.98332; 15.8057
90; 104.815; 90
1654.15Nguyen Thi Thanh, Chi; Pham Van, Thong; Le Thi Hong, Hai; Van Meervelt, Luc
Crystallization experiments with the dinuclear chelate ring complex di-μ-chlorido-bis[(η^2^-2-allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)platinum(II)]
Acta Crystallographica Section C, 2016, 72, 758-764
2020594 CIF
HKL
Paper
C4 H6 O3P b c n8.0707; 7.8733; 7.9305
90; 90; 90
503.93Seidel, Rüdiger W.; Goddard, Richard; Nöthling, Nils; Lehmann, Christian W.
Acetic anhydride at 100K: the first crystal structure determination
Acta Crystallographica Section C, 2016, 72, 753-757
2020596 CIF
HKL
Paper
C22 H38 B Bi Cl2 N6 O S3P -110.2899; 10.6653; 15.9818
72.157; 83.838; 67.742
1545.08Fujisawa, Kiyoshi; Kuboniwa, Ayaka; Kiss, Mercedesz; Szilagyi, Robert K.
Mono- and binuclear tris(3-<i>tert</i>-butyl-2-sulfanylidene-1<i>H</i>-imidazol-1-yl)hydroborate bismuth(III) dichloride complexes: a soft scorpionate ligand can coordinate to <i>p</i>-block elements
Acta Crystallographica Section C, 2016, 72, 768-776
2020597 CIF
HKL
Paper
C42 H68 B2 Bi2 Cl4 N12 S6P -110.8009; 11.3698; 11.869
95.125; 91.947; 99.549
1429.9Fujisawa, Kiyoshi; Kuboniwa, Ayaka; Kiss, Mercedesz; Szilagyi, Robert K.
Mono- and binuclear tris(3-<i>tert</i>-butyl-2-sulfanylidene-1<i>H</i>-imidazol-1-yl)hydroborate bismuth(III) dichloride complexes: a soft scorpionate ligand can coordinate to <i>p</i>-block elements
Acta Crystallographica Section C, 2016, 72, 768-776
2020598 CIF
HKL
Paper
C39 H48 B N6 O TlR -3 :H11.7826; 11.7826; 47.755
90; 90; 120
5741.6Fujisawa, Kiyoshi; Shimizu, Masaya; Szilagyi, Robert K.
Comparison of thallium(I) complexes with mesityl-substituted tris(pyrazolyl)hydroborate ligands, [Tl{HB(3-Ms-5-Mepz)~3~}] and [Tl{HB(3-Ms-5-Mepz)~2~(3-Me-5-Mspz)}]
Acta Crystallographica Section C, 2016, 72, 786-790
2020599 CIF
HKL
Paper
C39 H46 B N6 TlP -111.5262; 11.8485; 14.523
108.735; 100.095; 94.933
1827.5Fujisawa, Kiyoshi; Shimizu, Masaya; Szilagyi, Robert K.
Comparison of thallium(I) complexes with mesityl-substituted tris(pyrazolyl)hydroborate ligands, [Tl{HB(3-Ms-5-Mepz)~3~}] and [Tl{HB(3-Ms-5-Mepz)~2~(3-Me-5-Mspz)}]
Acta Crystallographica Section C, 2016, 72, 786-790
2020600 CIF
HKL
Paper
C51 H56 B2 Br6 N12 NiP -112.833; 21.295; 22.787
69.299; 74.191; 89.546
5578Trofimenko, Swiatoslaw; Jové, Fernando; Yap, Glenn P. A.
An unusual bis-heteroscorpionate complex with anomalous ligands: [tris(3,4-dibromo-5-phenylpyrazolyl)hydroborato][hydrotris(3-neopentylpyrazolyl)borato]nickel(II)
Acta Crystallographica Section C, 2016, 72, 802-805
2020601 CIF
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Paper
C36 H28 B N8 TlP 1 21/c 19.9552; 13.1693; 24.7993
90; 91.463; 90
3250.2Infantes, Lourdes; Claramunt, Rosa M.; Sanz, Dionisia; Alkorta, Ibon; Elguero, José
The structures of two scorpionates: thallium tetrakis(3-phenyl-1<i>H</i>-pyrazol-1-yl)borate and potassium tetrakis(3-cyclopropyl-1<i>H</i>-pyrazol-1-yl)borate
Acta Crystallographica Section C, 2016, 72, 819-825
2020602 CIF
HKL
Paper
C24 H28 B K N8C 1 2/c 119.547; 8.391; 17.153
90; 117.111; 90
2504.3Infantes, Lourdes; Claramunt, Rosa M.; Sanz, Dionisia; Alkorta, Ibon; Elguero, José
The structures of two scorpionates: thallium tetrakis(3-phenyl-1<i>H</i>-pyrazol-1-yl)borate and potassium tetrakis(3-cyclopropyl-1<i>H</i>-pyrazol-1-yl)borate
Acta Crystallographica Section C, 2016, 72, 819-825
2020603 CIF
HKL
Paper
C17 H16 Ag B F9 N7P -18.9547; 11.3267; 11.8011
102.919; 103.564; 96.901
1115.14Dias, H. V. Rasika; Kulkarni, Naveen
The silver(I) complex [HB{3-(CF~3~),5-(CH~3~)Pz}~3~]AgNCCH~3~ supported by a partially fluorinated scorpionate ligand
Acta Crystallographica Section C, 2016, 72, 853-856
2020604 CIF
HKL
Paper
C24 H25 Ag B F4 N8 O1.5C 1 2/c 120.4544; 11.9881; 21.4952
90; 93.493; 90
5261Semeniuc, Radu F.; Reger, Daniel L.; Smith, Mark D.
Silver(I) and rhenium(I) metal complexes of a 2,2'-bipyridine-functionalized third-generation tris(pyrazolyl)methane ligand
Acta Crystallographica Section C, 2016, 72, 826-831
2020605 CIF
HKL
C25 H20 Br N8 O4 ReP -18.8322; 11.4361; 14.4346
67.708; 73.552; 89.664
1285.31Semeniuc, Radu F.; Reger, Daniel L.; Smith, Mark D.
Silver(I) and rhenium(I) metal complexes of a 2,2'-bipyridine-functionalized third-generation tris(pyrazolyl)methane ligand
Acta Crystallographica Section C, 2016, 72, 826-831
2020606 CIF
HKL
Paper
C68 H98 B2 Co2 N14 O4P -113.175; 13.672; 19.571
77.203; 80.89; 89.522
3393Mikhalyova, Elena A.; Trofimenko, Swiatoslaw; Zeller, Matthias; Addison, Anthony W.; Pavlishchuk, Vitaly V.
New homodinuclear tris(3-alkylpyrazolyl)borate complexes of Co^II^ and Ni^II^ with a tetraacetylethane dianion as a bridging ligand
Acta Crystallographica Section C, 2016, 72, 777-785
2020607 CIF
HKL
Paper
C58 H92 B2 N12 Ni2 O4F d d 219.63; 61.387; 10.422
90; 90; 90
12559Mikhalyova, Elena A.; Trofimenko, Swiatoslaw; Zeller, Matthias; Addison, Anthony W.; Pavlishchuk, Vitaly V.
New homodinuclear tris(3-alkylpyrazolyl)borate complexes of Co^II^ and Ni^II^ with a tetraacetylethane dianion as a bridging ligand
Acta Crystallographica Section C, 2016, 72, 777-785
2020608 CIF
HKL
Paper
C23 H40 B N7 P RhP 1 21 18.4544; 15.0084; 10.6904
90; 95.975; 90
1349.1Jiao, Yunzhe; Brennessel, William W.; Jones, William D.
Nitrile coordination to rhodium does not lead to C—H activation
Acta Crystallographica Section C, 2016, 72, 850-852
2020609 CIF
HKL
Paper
C35 H31 B N6 Ni OP -111.69; 11.844; 25.618
91.698; 93.037; 119.345
3081.2Green, William L.; Sirianni, Eric R.; Yap, Glenn P. A.; Riordan, Charles G.
Steric and electronic factor comparisons in hydrotris(3-phenylpyrazolyl)borate nickel(II) aryloxides
Acta Crystallographica Section C, 2016, 72, 791-796
2020610 CIF
HKL
Paper
C37 H35 B N6 Ni OP -18.428; 13.516; 15.064
99.293; 102.679; 90.9
1649.8Green, William L.; Sirianni, Eric R.; Yap, Glenn P. A.; Riordan, Charles G.
Steric and electronic factor comparisons in hydrotris(3-phenylpyrazolyl)borate nickel(II) aryloxides
Acta Crystallographica Section C, 2016, 72, 791-796
2020611 CIF
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Paper
C41 H43 B N6 Ni O3P 21 21 2110.868; 11.985; 28.705
90; 90; 90
3739Green, William L.; Sirianni, Eric R.; Yap, Glenn P. A.; Riordan, Charles G.
Steric and electronic factor comparisons in hydrotris(3-phenylpyrazolyl)borate nickel(II) aryloxides
Acta Crystallographica Section C, 2016, 72, 791-796
2020612 CIF
HKL
Paper
C37 H31 B Cl4 N8 NiP -111.941; 11.986; 14.034
80.223; 81.483; 67.81
1825.1Green, William L.; Sirianni, Eric R.; Yap, Glenn P. A.; Riordan, Charles G.
Steric and electronic factor comparisons in hydrotris(3-phenylpyrazolyl)borate nickel(II) aryloxides
Acta Crystallographica Section C, 2016, 72, 791-796
2020613 CIF
HKL
Paper
C33 H27 B N6 Ni OP -18.505; 13.071; 13.531
79.484; 78.356; 87.112
1448.4Green, William L.; Sirianni, Eric R.; Yap, Glenn P. A.; Riordan, Charles G.
Steric and electronic factor comparisons in hydrotris(3-phenylpyrazolyl)borate nickel(II) aryloxides
Acta Crystallographica Section C, 2016, 72, 791-796
2020614 CIF
HKL
Paper
C44 H35 Fe N6 P S3P 1 21/c 18.956; 15.7745; 28.455
90; 94.067; 90
4009.9Ishida, Takayuki; Kanetomo, Takuya; Yamasaki, Masaru
An iron(II) complex tripodally chelated with 1,1,1-tris(pyridin-2-yl)ethane showing room-temperature spin-crossover behaviour
Acta Crystallographica Section C, 2016, 72, 797-801
2020615 CIF
HKL
Paper
C44 H35 Fe N6 P S3P 1 21/c 19.069; 15.984; 28.82
90; 93.316; 90
4170.7Ishida, Takayuki; Kanetomo, Takuya; Yamasaki, Masaru
An iron(II) complex tripodally chelated with 1,1,1-tris(pyridin-2-yl)ethane showing room-temperature spin-crossover behaviour
Acta Crystallographica Section C, 2016, 72, 797-801
2020616 CIF
HKL
Paper
C31 H42 B Fe N6 TlP 1 21/c 19.669; 14.332; 23.263
90; 97.809; 90
3193.8Sirianni, Eric R.; Cummins, Daniel C.; Yap, Glenn P. A.; Theopold, Klaus H.
FcTp(<i>R</i>) (<i>R</i> = ^<i>i^</i>Pr or ^<i>t^</i>Bu): third-generation ferrocenyl scorpionates
Acta Crystallographica Section C, 2016, 72, 813-818
2020617 CIF
HKL
Paper
C28 H36 B Fe N6 TlC 1 2/c 121.4659; 15.7392; 17.27
90; 97.87; 90
5779.8Sirianni, Eric R.; Cummins, Daniel C.; Yap, Glenn P. A.; Theopold, Klaus H.
FcTp(<i>R</i>) (<i>R</i> = ^<i>i^</i>Pr or ^<i>t^</i>Bu): third-generation ferrocenyl scorpionates
Acta Crystallographica Section C, 2016, 72, 813-818
2020618 CIF
HKL
Paper
C31 H42 B Cl Co Fe N6P 1 21/n 110.3229; 18.362; 16.642
90; 98.595; 90
3119Sirianni, Eric R.; Cummins, Daniel C.; Yap, Glenn P. A.; Theopold, Klaus H.
FcTp(<i>R</i>) (<i>R</i> = ^<i>i^</i>Pr or ^<i>t^</i>Bu): third-generation ferrocenyl scorpionates
Acta Crystallographica Section C, 2016, 72, 813-818
2020619 CIF
Paper
C43 H54 B Co Fe I N6P 1 21/n 110.015; 27.481; 15.483
90; 92.66; 90
4257Sirianni, Eric R.; Cummins, Daniel C.; Yap, Glenn P. A.; Theopold, Klaus H.
FcTp(<i>R</i>) (<i>R</i> = ^<i>i^</i>Pr or ^<i>t^</i>Bu): third-generation ferrocenyl scorpionates
Acta Crystallographica Section C, 2016, 72, 813-818
2020620 CIF
HKL
Paper
C28 H36 B Co Fe I N6P 1 21/n 112.7937; 16.0612; 14.7531
90; 99.794; 90
2987.3Sirianni, Eric R.; Cummins, Daniel C.; Yap, Glenn P. A.; Theopold, Klaus H.
FcTp(<i>R</i>) (<i>R</i> = ^<i>i^</i>Pr or ^<i>t^</i>Bu): third-generation ferrocenyl scorpionates
Acta Crystallographica Section C, 2016, 72, 813-818
2020621 CIF
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Paper
C32 H40 B2 N16 SmP 1 21/c 111.2742; 22.304; 14.4624
90; 95.3065; 90
3621.1Arikawa, Yasuhiro; Inada, Kei-ichiro; Onishi, Masayoshi
Side-on coordination mode of a pyrazolyl group in the structure of a divalent [Sm{B(3-Mepz)~4~}~2~] complex (3-Mepz is 3-methylpyrazol-1-yl)
Acta Crystallographica Section C, 2016, 72, 838-841
2020622 CIF
Paper
C29 H42 B Cl2 N6 S3 ZrP 1 21/n 114.761; 11.358; 20.73
90; 102.13; 90
3397.9Rong, Yi; Sambade, David; Parkin, Gerard
Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium
Acta Crystallographica Section C, 2016, 72, 806-812
2020623 CIF
Paper
C29 H42 B Cl2 N6 S3 TiP 1 21/n 114.72; 11.327; 20.422
90; 102.593; 90
3323Rong, Yi; Sambade, David; Parkin, Gerard
Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium
Acta Crystallographica Section C, 2016, 72, 806-812
2020624 CIF
Paper
C19 H29 B Cl2 N4 S2 ZrP 1 21 110.202; 18.21; 13.356
90; 90.814; 90
2481Rong, Yi; Sambade, David; Parkin, Gerard
Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium
Acta Crystallographica Section C, 2016, 72, 806-812
2020625 CIF
Paper
C25 H34 Cl2 N4 S2 ZrP -110.5741; 10.7222; 14.246
93.93; 92.094; 118.274
1414.7Rong, Yi; Sambade, David; Parkin, Gerard
Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium
Acta Crystallographica Section C, 2016, 72, 806-812
2020626 CIF
Paper
C66 H79 B Hf N6 S3P a -323.1441; 23.1441; 23.1441
90; 90; 90
12397.1Rong, Yi; Sambade, David; Parkin, Gerard
Molecular structures of tris(1-<i>tert</i>-butyl-2-mercaptoimidazolyl)hydroborate complexes of titanium, zirconium and hafnium
Acta Crystallographica Section C, 2016, 72, 806-812
2020627 CIF
HKL
C21 H29 B Cl N3 Ni O3P 1 21/c 110.8792; 13.221; 15.972
90; 96.899; 90
2280.7Takayama, Tomoaki; Nakazawa, Jun; Hikichi, Shiro
A pseudotetrahedral nickel(II) complex with a tridentate oxazoline-based scorpionate ligand: chlorido[tris(4,4-dimethyloxazolin-2-yl)phenylborato]nickel(II)
Acta Crystallographica Section C, 2016, 72, 842-845
2020628 CIF
HKL
Paper
C70 H86 B4 Cd2 F16 N28 O6P 1 21/n 114.4909; 16.1418; 18.2891
90; 97.687; 90
4239.5Semeniuc, Radu F.; Reger, Daniel L.; Smith, Mark D.
A cadmium(II) coordination polymer formed from a third generation tetratopic tris(pyrazolyl)methane ligand
Acta Crystallographica Section C, 2016, 72, 832-837
2020629 CIF
HKL
Paper
C9 Br9 N6 O PP n a 2117.0187; 9.7329; 25.7877
90; 90; 90
4271.5Nicolas, Emmanuel; Cheisson, Thibault; de Jong, G. Bas; Tazelaar, Cornelis G. J.; Slootweg, J. Chris
A new synthetic route to the electron-deficient ligand tris(3,4,5-tribromopyrazol-1-yl)phosphine oxide
Acta Crystallographica Section C, 2016, 72, 846-849
2020630 CIF
HKL
Paper
C29 H24 Au Cl N2P -16.9686; 11.8758; 15.1008
98.249; 95.337; 102.467
1197.63Tacke, Matthias; Dada, Oyinlola; O'Beirne, Cillian; Zhu, Xiangming; Müller-Bunz, Helge
The non-isomorphous crystal structures of NHC—Au—Cl and NHC—Au—Br (NHC is 1,3-dibenzyl-4,5-diphenylimidazol-2-ylidene)
Acta Crystallographica Section C, 2016, 72, 857-860
2020631 CIF
HKL
Paper
C29 H24 Au Br N2P -17.0973; 15.3919; 45.4224
87.896; 87.876; 89.871
4955.23Tacke, Matthias; Dada, Oyinlola; O'Beirne, Cillian; Zhu, Xiangming; Müller-Bunz, Helge
The non-isomorphous crystal structures of NHC—Au—Cl and NHC—Au—Br (NHC is 1,3-dibenzyl-4,5-diphenylimidazol-2-ylidene)
Acta Crystallographica Section C, 2016, 72, 857-860
2020632 CIF
HKL
Paper
C66 H39 Cu N11 O6P -18.234; 11.872; 14.212
104.37; 94.85; 96.85
1326.8Seidel, Rüdiger W.; Goddard, Richard; Mayer-Gall, Thomas; Oppel, Iris M.
A synchrotron study of [5,10,15,20-tetrakis(3-cyanophenyl)porphyrinato-κ^4^<i>N</i>^5^,<i>N</i>^10^,<i>N</i>^15^,<i>N</i>^20^]copper(II) nitrobenzene trisolvate at 80K
Acta Crystallographica Section C, 2016, 72, 861-866
2020633 CIF
HKL
Paper
C20 H18 N4P b c a7.9688; 12.5553; 32.4903
90; 90; 90
3250.7Geiger, David K.; DeStefano, Matthew R.
Conformational differences and intermolecular C—H···N interactions in three polymorphs of a bis(pyridinyl)-substituted benzimidazole
Acta Crystallographica Section C, 2016, 72, 867-874
2020634 CIF
HKL
Paper
C20 H18 N4P -16.192; 8.214; 16.488
85.335; 85.257; 85.774
831.1Geiger, David K.; DeStefano, Matthew R.
Conformational differences and intermolecular C—H···N interactions in three polymorphs of a bis(pyridinyl)-substituted benzimidazole
Acta Crystallographica Section C, 2016, 72, 867-874
2020637 CIF
HKL
C23 H19 Cl2 N5 O5 S2P -18.0598; 12.3474; 13.4484
100.996; 98.101; 103.659
1252.1Freire, Eleonora; Polla, Griselda; Baggio, Ricardo
Hydrogen-bonding synthons in lamotrigine salts: 3,5-diamino-6-(2,3-dichlorophenyl)-1,2,4-triazin-2-ium 2-[(2-carboxyphenyl)disulfanyl]benzoate in its monohydrate and anhydrous forms
Acta Crystallographica Section C, 2016, 72, 910-916
2020638 CIF
HKL
C23 H17 Cl2 N5 O4 S2P -18.5368; 12.31; 12.9348
64.689; 86.474; 77.23
1197.57Freire, Eleonora; Polla, Griselda; Baggio, Ricardo
Hydrogen-bonding synthons in lamotrigine salts: 3,5-diamino-6-(2,3-dichlorophenyl)-1,2,4-triazin-2-ium 2-[(2-carboxyphenyl)disulfanyl]benzoate in its monohydrate and anhydrous forms
Acta Crystallographica Section C, 2016, 72, 910-916
2020639 CIF
HKL
Paper
C21 H17 N O2P 1 21/c 116.4815; 24.8758; 39.975
90; 90.0317; 90
16389.4Lifshits, Liubov M.; Singh, Varun; Zeller, Matthias; Klosterman, Jeremy K.
Ethyl 4-(9<i>H</i>-carbazol-9-yl)benzoate: fivefold superstructure with ten crystallographically independent molecules refined from a twinned crystal
Acta Crystallographica Section C, 2016, 72, 901-909
2020640 CIF
HKL
Paper
C22 H18 Co N4 O4P 1 21/c 112.4659; 14.4336; 11.849
90; 115.366; 90
1926.4Liu, Ping; Liu, Qiuxia; Zhao, Ning; An, Caixia; Lian, Zhaoxun
Structure and third-order nonlinear optical properties of the two-dimensional Co^II^ coordination polymer [Co(1,2-BIB)(PA)]~<i>n~</i> {1,2-BIB is 1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene and H~2~PA is phthalic acid}
Acta Crystallographica Section C, 2016, 72, 890-894
2020641 CIF
HKL
Paper
C21 H18 O9P 1 21/c 114.7254; 5.8819; 21.151
90; 99.321; 90
1807.77Tamboli, Majid I.; Krishanaswamy, Shobhana; Gonnade, Rajesh G.; Shashidhar, Mysore S.
Engineering crystals that facilitate the acyl-transfer reaction: insight from a comparison of the crystal structures of <i>my</i>o-inositol-1,3,5-orthoformate-derived benzoates and carbonates
Acta Crystallographica Section C, 2016, 72, 875-881
2020642 CIF
HKL
C21 H18 O8 SP 1 21/c 114.5888; 6.044; 21.5364
90; 100.216; 90
1868.86Tamboli, Majid I.; Krishanaswamy, Shobhana; Gonnade, Rajesh G.; Shashidhar, Mysore S.
Engineering crystals that facilitate the acyl-transfer reaction: insight from a comparison of the crystal structures of <i>my</i>o-inositol-1,3,5-orthoformate-derived benzoates and carbonates
Acta Crystallographica Section C, 2016, 72, 875-881
2020643 CIF
HKL
Paper
C6 H9 N3 O6 SP -17.835; 8.105; 15.881
97.03; 90.21; 90.15
1000.9Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis and characterization of four organic‒inorganic salts: sulfates of 2-aminopyridinium derivatives
Acta Crystallographica Section C, 2016, 72, 882-889
2020644 CIF
HKL
C12 H16 N6 O8 SC 1 2/c 110.557; 13.632; 12.211
90; 97.12; 90
1743.8Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis and characterization of four organic‒inorganic salts: sulfates of 2-aminopyridinium derivatives
Acta Crystallographica Section C, 2016, 72, 882-889
2020645 CIF
HKL
C6 H10 N2 O4 SP -18.029; 10.645; 11.541
82.95; 87.95; 67.93
907.1Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis and characterization of four organic‒inorganic salts: sulfates of 2-aminopyridinium derivatives
Acta Crystallographica Section C, 2016, 72, 882-889
2020646 CIF
HKL
Paper
C12 H20 N4 O5 SP 1 21/c 110.909; 10.7; 14.267
90; 110.34; 90
1561.5Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis and characterization of four organic‒inorganic salts: sulfates of 2-aminopyridinium derivatives
Acta Crystallographica Section C, 2016, 72, 882-889
2020647 CIF
HKL
Paper
C20 H24 Mn N6 O6 SP -18.8547; 9.9689; 12.9721
97.005; 97.885; 90.929
1125.14Lu, Xin-Hua; Zhong, Kai-Long
A new three-dimensional manganese(II) coordination polymer based on the 1,3,5-tris[(1<i>H</i>-imidazol-1-yl)methyl]benzene ligand
Acta Crystallographica Section C, 2016, 72, 895-900
2020648 CIF
HKL
C20 H18 Br2 N10 ZnP b c n11.498; 11.715; 17.071
90; 90; 90
2299.4Liu, Chun-Li; Wei, Xu; Huang, Qiu-Ying; Meng, Xiang-Ru
Syntheses, structures and properties of two new isostructural zinc(II) complexes based on 1-[(benzotriazol-1-yl)methyl]-1<i>H</i>-imidazole
Acta Crystallographica Section C, 2016, 72, 917-922
2020649 CIF
HKL
C20 H18 I2 N10 ZnP b c n11.729; 11.853; 17.563
90; 90; 90
2441.7Liu, Chun-Li; Wei, Xu; Huang, Qiu-Ying; Meng, Xiang-Ru
Syntheses, structures and properties of two new isostructural zinc(II) complexes based on 1-[(benzotriazol-1-yl)methyl]-1<i>H</i>-imidazole
Acta Crystallographica Section C, 2016, 72, 917-922
2020653 CIF
HKL
Paper
C24 H16 N4P 1 21/n 112.3897; 8.794; 17.1791
90; 108.369; 90
1776.38Granifo, Juan; Arévalo, Beatriz; Gaviño, Rubén; Suárez, Sebastián; Baggio, Ricardo
Structural and theoretical characterization of a new twisted 4'-substituted terpyridine compound: 4'-(isoquinolin-4-yl)-2,2':6',2''-terpyridine
Acta Crystallographica Section C, 2016, 72, 932-938
2020654 CIF
HKL
Paper
C56 H66 Cd N14 O22 S2P -110.8873; 11.4736; 13.4521
87.806; 88.438; 69.247
1570Yuan, Gan-Yin; Zhang, Lei; Wang, Meng-Jie; Zhang, Kou-Lin
Synthesis and characterization of a cadmium(II)‒organic supramolecular coordination compound based on the multifunctional 2-amino-5-sulfobenzoic acid ligand
Acta Crystallographica Section C, 2016, 72, 939-946
2020655 CIF
HKL
Paper
C34 H28 Ag2 Cl4 N4 O4C 1 2/c 136.3376; 9.6778; 9.4818
90; 93.86; 90
3326.9Hamamci Alisir, Sevim; Dege, Necmi
A new antibacterial silver(I) complex incorporating 2,5-dimethylpyrazine and the anti-inflammatory diclofenac
Acta Crystallographica Section C, 2016, 72, 947-951
2020656 CIF
HKL
Paper
C20 H6 I2 N4P n a 218.766; 12.2655; 16.4903
90; 90; 90
1773.03Ren, Yi; Lee, Semin; Bertke, Jeffery; Gray, Danielle L.; Moore, Jeffrey S.
Synthesis and structures of 11,11,12,12-tetracyano-2,6-diiodo-9,10-anthraquinodimethane and its 2:1 cocrystals with anthracene, pyrene and tetrathiafulvalene
Acta Crystallographica Section C, 2016, 72, 923-931
2020657 CIF
HKL
C27 H11 I2 N4P 1 21/n 113.7727; 8.5843; 20.5752
90; 105.115; 90
2348.4Ren, Yi; Lee, Semin; Bertke, Jeffery; Gray, Danielle L.; Moore, Jeffrey S.
Synthesis and structures of 11,11,12,12-tetracyano-2,6-diiodo-9,10-anthraquinodimethane and its 2:1 cocrystals with anthracene, pyrene and tetrathiafulvalene
Acta Crystallographica Section C, 2016, 72, 923-931
2020658 CIF
HKL
C28 H11 I2 N4P -18.7758; 12.0214; 13.3155
66.461; 74.489; 74.462
1220.2Ren, Yi; Lee, Semin; Bertke, Jeffery; Gray, Danielle L.; Moore, Jeffrey S.
Synthesis and structures of 11,11,12,12-tetracyano-2,6-diiodo-9,10-anthraquinodimethane and its 2:1 cocrystals with anthracene, pyrene and tetrathiafulvalene
Acta Crystallographica Section C, 2016, 72, 923-931
2020659 CIF
HKL
C46 H16 I4 N8 S4P -18.615; 11.631; 12.45
80.247; 74.695; 70.392
1129Ren, Yi; Lee, Semin; Bertke, Jeffery; Gray, Danielle L.; Moore, Jeffrey S.
Synthesis and structures of 11,11,12,12-tetracyano-2,6-diiodo-9,10-anthraquinodimethane and its 2:1 cocrystals with anthracene, pyrene and tetrathiafulvalene
Acta Crystallographica Section C, 2016, 72, 923-931
2020660 CIF
HKL
Paper
C34 H50 Cl6 N2 O5I 1 2/a 114.8441; 13.2872; 21.0311
90; 105.191; 90
4003.2Cai, Xiao-Qing; Tian, Bei; Zhang, Jian-Nan; Jin, Zhi-Min
The hydrogen-bonded complex bis(<i>tert</i>-butylammonium) 2,6-dichlorophenolate 2,4-dichlorophenol‒2,4-dichlorophenolate tetrahydrofuran disolvate containing a chiral <i>R</i>~5~^3^(10) hydrogen-bonded ring as a supramolecular synthon
Acta Crystallographica Section C, 2016, 72, 720-723
2020663 CIF
HKL
Paper
Br9 H9 O3 Sb2P 1 21/n 113.4679; 7.6319; 19.1397
90; 90.24; 90
1967.27Chang, Jen-Hui; Doert, Thomas; Ruck, Michael
(H~3~O)~3~Sb~2~Br~9~: the first member of the <i>M</i>~3~<i>E</i>~2~<i>X</i>~9~ structure family with oxonium cations
Acta Crystallographica Section C, 2016, 72, 966-970
2020664 CIF
HKL
Paper
C24 H20 Ag2 N8 ZnP -19.713; 10.334; 14.717
96.909; 101.43; 110.323
1328.7Krinchampa, Pattiya; Chainok, Kittipong; Phengthaisong, Siriporn; Youngme, Sujittra; Kielar, Filip; Wannarit, Nanthawat
A novel one-dimensional double-chain-like Zn^II^ coordination polymer: poly[bis(1-benzyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)tris(μ-cyanido-κ^2^<i>C</i>:<i>N</i>)(cyanido-κ<i>C</i>)disilver(I)zinc(II)]
Acta Crystallographica Section C, 2016, 72, 960-965
2020665 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/c 130.904; 9.3351; 14.353
90; 90.222; 90
4140.7Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020666 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/c 130.92; 9.3363; 14.3462
90; 90.314; 90
4141.4Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020667 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/c 130.975; 9.3542; 14.3524
90; 90.149; 90
4158.5Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020668 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/c 130.9991; 9.3611; 14.3546
90; 90.0906; 90
4165.5Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020669 CIF
HKL
Paper
C22 H28 N4 O4P 1 21/c 131.0071; 9.3634; 14.3544
90; 90.0656; 90
4167.5Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020670 CIF
HKL
Paper
C22 H28 N4 O4P c c n31.0109; 9.3651; 14.3551
90; 90; 90
4169Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020671 CIF
HKL
Paper
C22 H28 N4 O4P c c n31.0133; 9.3657; 14.354
90; 90; 90
4169.3Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020672 CIF
HKL
Paper
C22 H28 N4 O4P c c n31.0259; 9.3706; 14.3567
90; 90; 90
4173.9Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020673 CIF
HKL
Paper
C22 H28 N4 O4P c c n31.3604; 9.5095; 14.4182
90; 90; 90
4299.8Chia, Tze Shyang; Quah, Ching Kheng
Monoclinic-to-orthorhombic phase transition of the hexamethylenetetramine‒2-methylbenzoic acid (1/2) cocrystal with temperature-dependent dynamic molecular disorder
Acta Crystallographica Section C, 2016, 72, 971-980
2020674 CIF
HKL
Paper
C31 H29 N O8 S4P 1 21/c 114.113; 12.2433; 18.8793
90; 105.68; 90
3140.75Yang, Yunxia; Li, Lihua; Zhang, Li; Dong, Wenjing; Ding, Keying
Three polymorphs of an inclusion compound of 2,2'-(disulfanediyl)dibenzoic acid and trimethylamine
Acta Crystallographica Section C, 2016, 72, 981-989
2020675 CIF
HKL
C68 H76 N4 O16 S8C 1 2/c 131.7088; 11.5254; 23.2263
90; 123.43; 90
7083.9Yang, Yunxia; Li, Lihua; Zhang, Li; Dong, Wenjing; Ding, Keying
Three polymorphs of an inclusion compound of 2,2'-(disulfanediyl)dibenzoic acid and trimethylamine
Acta Crystallographica Section C, 2016, 72, 981-989
2020676 CIF
HKL
C17 H19 N O4 S2C 1 2/c 113.5363; 12.1071; 22.1248
90; 96.532; 90
3602.39Yang, Yunxia; Li, Lihua; Zhang, Li; Dong, Wenjing; Ding, Keying
Three polymorphs of an inclusion compound of 2,2'-(disulfanediyl)dibenzoic acid and trimethylamine
Acta Crystallographica Section C, 2016, 72, 981-989
2020677 CIF
HKL
Paper
C50 H80 Mg2 N4 O2 Si4P -110.4898; 11.3067; 12.737
76.033; 66.454; 81.772
1342.1Rood, Jeffrey A.; Landis, Ashley M.; Forster, Daniel R.; Goldkamp, Timothy; Oliver, Allen G.
Solvent dependence of the solid-state structures of salicylaldiminate magnesium amide complexes
Acta Crystallographica Section C, 2016, 72, 990-996
2020678 CIF
HKL
C69 H91 Mg N5 O2C 1 2/c 131.633; 13.4541; 17.467
90; 122.934; 90
6239.2Rood, Jeffrey A.; Landis, Ashley M.; Forster, Daniel R.; Goldkamp, Timothy; Oliver, Allen G.
Solvent dependence of the solid-state structures of salicylaldiminate magnesium amide complexes
Acta Crystallographica Section C, 2016, 72, 990-996
2020679 CIF
HKL
Paper
C20 H29 Cl N4 O7 SP 1 21/c 117.0284; 7.8695; 22.0555
90; 126.512; 90
2375.5Beloborodova, Alina A.; Minkov, Vasily S.; Boldyreva, Elena V.
A new solvate of furosemide with dimethylacetamide
Acta Crystallographica Section C, 2016, 72, 997-1001
2020680 CIF
HKL
C24 H26 N12 O5 ZnP b c n13.861; 10.521; 18.634
90; 90; 90
2717.4Liu, Chun-Li; Huang, Qiu-Ying; Meng, Xiang-Ru
A one-dimensional zinc(II) coordination polymer with a three-dimensional supramolecular architecture incorporating 1-[(1<i>H</i>-benzimidazol-2-yl)methyl]-1<i>H</i>-tetrazole and adipate
Acta Crystallographica Section C, 2016, 72, 1002-1006
2020681 CIF
HKL
Paper
C8 H9 F3 I N OP 1 21/n 17.8651; 9.2595; 14.7958
90; 101.151; 90
1057.19Lu, Norman; Alagesan, Mani; Ho, Chi-Liang; Wei, Rong-Jyun; Kung, Chih-Chieh; Chang, Jung-Shan; Wen, Yuh-Sheng; Liu, Ling-Kang
New fluorous ponytailed 4-[(2,2,2-trifluoroethoxy)methyl]pyridinium halide salts
Acta Crystallographica Section C, 2016, 72, 1007-1011
2020682 CIF
HKL
C8 H9 Cl F3 N OP b c a9.2236; 13.5704; 15.86
90; 90; 90
1985.16Lu, Norman; Alagesan, Mani; Ho, Chi-Liang; Wei, Rong-Jyun; Kung, Chih-Chieh; Chang, Jung-Shan; Wen, Yuh-Sheng; Liu, Ling-Kang
New fluorous ponytailed 4-[(2,2,2-trifluoroethoxy)methyl]pyridinium halide salts
Acta Crystallographica Section C, 2016, 72, 1007-1011
2020684 CIF
HKL
Paper
C10 H9 I N2P 21 21 218.7561; 9.0016; 12.8869
90; 90; 90
1015.73Nwachukwu, Chideraa I.; Bowling, Nathan P.; Bosch, Eric
C—I···N and C—I···π halogen bonding in the structures of 1-benzyliodoimidazole derivatives
Acta Crystallographica Section C, 2017, 73, 2-8
2020685 CIF
HKL
C10 H9 I N2P 1 21/n 18.4574; 6.1526; 19.4261
90; 96.362; 90
1004.61Nwachukwu, Chideraa I.; Bowling, Nathan P.; Bosch, Eric
C—I···N and C—I···π halogen bonding in the structures of 1-benzyliodoimidazole derivatives
Acta Crystallographica Section C, 2017, 73, 2-8
2020686 CIF
HKL
C14 H11 I N2P -16.4606; 8.2346; 12.3451
108.064; 94.174; 95.366
618.05Nwachukwu, Chideraa I.; Bowling, Nathan P.; Bosch, Eric
C—I···N and C—I···π halogen bonding in the structures of 1-benzyliodoimidazole derivatives
Acta Crystallographica Section C, 2017, 73, 2-8
2020687 CIF
HKL
Paper
C17 H19 N5 O2 SP n a 2130.5388; 8.0984; 15.081
90; 90; 90
3729.76Patel, Urmila H.; Purohit, Ketankumar P.
Pyridine and 3-methylpyridine solvates of the triple sulfa drug constitutent sulfamethazine
Acta Crystallographica Section C, 2017, 73, 9-12
2020688 CIF
HKL
C18 H21 N5 O2 SP 21 21 219.692; 25.1673; 7.9853
90; 90; 90
1947.79Patel, Urmila H.; Purohit, Ketankumar P.
Pyridine and 3-methylpyridine solvates of the triple sulfa drug constitutent sulfamethazine
Acta Crystallographica Section C, 2017, 73, 9-12
2020689 CIF
HKL
C6 H9 N3 SP n a 218.843; 17.485; 5.041
90; 90; 90
779.4Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020690 CIF
HKL
C12 H18 Cu2 N8 O6 S2P -17.235; 7.548; 10.297
105.42; 98.15; 112.43
482Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020691 CIF
HKL
C12 H18 B2 Cu2 F8 N6 S2P -17.754; 7.965; 10.372
67.57; 89.99; 61.07
504.6Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020692 CIF
HKL
C10 H16 Cu2 N8 O7 S4P 1 21/c 17.379; 18.78; 14.702
90; 94.82; 90
2030.2Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020693 CIF
HKL
C11 H19.5 Cu2 F6 N6.5 O3 S4 SiP 1 21/n 111.899; 11.442; 17.678
90; 102.04; 90
2353.9Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020694 CIF
HKL
C23 H30 Cu2 N6 O8 S6P 1 21/c 114.944; 16.587; 14.658
90; 117.91; 90
3210.7Ardan, Bohdan; Kinzhybalo, Vasyl; Slyvka, Yurii; Shyyka, Olga; Luk`yanov, Mykhaylo; Lis, Tadeusz; Mys`kiv, Marian
Ligand-forced dimerization of copper(I)‒olefin complexes bearing a 1,3,4-thiadiazole core
Acta Crystallographica Section C, 2017, 73, 36-46
2020695 CIF
HKL
Paper
C19 H19 N O SP 1 21 111.4261; 8.1847; 16.8243
90; 93.067; 90
1571.14Mateus-Ruíz, Jeferson B.; Acosta Quintero, Lina M.; Palma, Alirio; Macías, Mario A.; Cobo, Justo; Glidewell, Christopher
Three tetracyclic dibenzoazepine derivatives exhibiting different molecular conformations, different patterns of intermolecular hydrogen bonding and different modes of supramolecular aggregation
Acta Crystallographica Section C, 2017, 73, 28-35
2020696 CIF
HKL
Paper
C20 H21 N O SC 1 2/c 118.1021; 12.4436; 14.8429
90; 97.645; 90
3313.7Mateus-Ruíz, Jeferson B.; Acosta Quintero, Lina M.; Palma, Alirio; Macías, Mario A.; Cobo, Justo; Glidewell, Christopher
Three tetracyclic dibenzoazepine derivatives exhibiting different molecular conformations, different patterns of intermolecular hydrogen bonding and different modes of supramolecular aggregation
Acta Crystallographica Section C, 2017, 73, 28-35
2020697 CIF
HKL
Paper
C22 H20 Cl N O3P -16.8533; 10.612; 13.561
72.45; 75.84; 82.46
910Mateus-Ruíz, Jeferson B.; Acosta Quintero, Lina M.; Palma, Alirio; Macías, Mario A.; Cobo, Justo; Glidewell, Christopher
Three tetracyclic dibenzoazepine derivatives exhibiting different molecular conformations, different patterns of intermolecular hydrogen bonding and different modes of supramolecular aggregation
Acta Crystallographica Section C, 2017, 73, 28-35
2020698 CIF
HKL
Paper
C45 H52 N4 O9 RuC 1 2/c 139.3876; 9.6153; 29.5299
90; 130.719; 90
8476.3Andreev, Sergey V.; Zverev, Sergey A.; Zamilatskov, Ilya A.; Kurochkina, Nadezhda M.; Ponomarev, Gelii V.; Fitch, Andrew N.; Chernyshev, Vladimir V.
Polymeric structure of a coproporphyrin I ruthenium(II) complex: a powder diffraction study
Acta Crystallographica Section C, 2017, 73, 47-51
2020699 CIF
HKL
Paper
C16 H16 N2 O3 SP -16.545; 9.3526; 12.782
94.047; 93.143; 95.735
775.05Okuniewski, Andrzej; Rosiak, Damian; Chojnacki, Jarosław; Becker, Barbara
Crystallographic study of self-organization in the solid state including quasi-aromatic pseudo-ring stacking interactions in 1-benzoyl-3-(3,4-dimethoxyphenyl)thiourea and 1-benzoyl-3-(2-hydroxypropyl)thiourea
Acta Crystallographica Section C, 2017, 73, 52-56
2020700 CIF
HKL
Paper
C11 H14 N2 O2 SP 1 21/c 122.415; 8.1479; 13.4592
90; 102.618; 90
2398.8Okuniewski, Andrzej; Rosiak, Damian; Chojnacki, Jarosław; Becker, Barbara
Crystallographic study of self-organization in the solid state including quasi-aromatic pseudo-ring stacking interactions in 1-benzoyl-3-(3,4-dimethoxyphenyl)thiourea and 1-benzoyl-3-(2-hydroxypropyl)thiourea
Acta Crystallographica Section C, 2017, 73, 52-56
2020701 CIF
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C15 H29 B N O6 PP 1 21/c 18.437; 23.5403; 10.3281
90; 98.1871; 90
2030.35Zhang, Rui; Zhang, Yundi; Ge, Chunhua; Miao, Jinpeng; Zhang, Xiangdong
Two closely related {4-[(<i>N</i>-substituted amino)(diethoxyphosphoryl)methyl]phenyl}boronic acids
Acta Crystallographica Section C, 2017, 73, 57-60
2020702 CIF
HKL
C17 H22 B N2 O7 PP b c n10.259; 14.5721; 27.577
90; 90; 90
4122.6Zhang, Rui; Zhang, Yundi; Ge, Chunhua; Miao, Jinpeng; Zhang, Xiangdong
Two closely related {4-[(<i>N</i>-substituted amino)(diethoxyphosphoryl)methyl]phenyl}boronic acids
Acta Crystallographica Section C, 2017, 73, 57-60
2020704 CIF
HKL
Paper
C38 H47 N5 PdC 1 2/c 129.525; 4.94; 25.663
90; 117.225; 90
3328.4Erzina, Dina R.; Zamilatskov, Ilya A.; Kurochkina, Nadezhda M.; Ponomarev, Gelii V.; Tafeenko, Victor A.
Structural explanation of the spectral features of the nonsymmetrical complex {2,3,7,8,12,13,17,18-octaethyl-5-[(methylimino)methyl]porphyrinato-κ^4^<i>N</i>^21^,<i>N</i>^22^,<i>N</i>^23^,<i>N</i>^24^}palladium(II)
Acta Crystallographica Section C, 2017, 73, 68-71
2020705 CIF
HKL
Paper
C28 H16 N4 O8 Zn2C 1 2/c 19.4371; 18.909; 14.4981
90; 104.162; 90
2508.5Su, Feng; Lu, Liping; Zhou, Chengyong; Wang, Xiaoxia; Sun, Long; Han, Chun
A three-dimensional Zn^II^ coordination polymer constructed from 1,1'-biphenyl-2,2',4,4'-tetracarboxylate and 1,4-bis(1<i>H</i>-imidazol-1-yl)benzene ligands exhibiting photoluminescence
Acta Crystallographica Section C, 2017, 73, 72-77
2020706 CIF
HKL
Paper
C12 H16 N2 O2 S2P n a 2112.8212; 10.5085; 10.6608
90; 90; 90
1436.35Szczesio, Małgorzata; Olczak, Andrzej; Mazerant, Ida; Gobis, Katarzyna; Foks, Henryk; Główka, Marek L.
Planarity of benzoylthiocarbazate tuberculostatics. III. Diesters of 3-(2-hydroxybenzoyl)dithiocarbazic acid
Acta Crystallographica Section C, 2017, 73, 84-90
2020707 CIF
HKL
C16 H16 N2 O2 S2P 1 21/c 113.2762; 12.6138; 10.1742
90; 108.597; 90
1614.84Szczesio, Małgorzata; Olczak, Andrzej; Mazerant, Ida; Gobis, Katarzyna; Foks, Henryk; Główka, Marek L.
Planarity of benzoylthiocarbazate tuberculostatics. III. Diesters of 3-(2-hydroxybenzoyl)dithiocarbazic acid
Acta Crystallographica Section C, 2017, 73, 84-90
2020708 CIF
HKL
C25 H28 N2 O3 S2P -18.795; 10.254; 14.044
74.95; 76.74; 88.99
1189.3Szczesio, Małgorzata; Olczak, Andrzej; Mazerant, Ida; Gobis, Katarzyna; Foks, Henryk; Główka, Marek L.
Planarity of benzoylthiocarbazate tuberculostatics. III. Diesters of 3-(2-hydroxybenzoyl)dithiocarbazic acid
Acta Crystallographica Section C, 2017, 73, 84-90
2020709 CIF
Paper
C22 H26 N4 O4 ZnP 1 21/n 19.491; 18.7233; 11.9855
90; 101.315; 90
2088.5Tan, Xiong-Wen; Li, Heng-Feng; Li, Chang-Hong
Two new isomeric zinc(II) metal‒organic frameworks based on 1,5-bis(2-methyl-1<i>H</i>-imidazol-1-yl)pentane and 5-methylisophthalate ligands
Acta Crystallographica Section C, 2017, 73, 78-83
2020710 CIFC31 H32 N4 O8 Zn2P 1 21/n 111.1005; 17.486; 16.372
90; 95.625; 90
3162.6Tan, Xiong-Wen; Li, Heng-Feng; Li, Chang-Hong
Two new isomeric zinc(II) metal‒organic frameworks based on 1,5-bis(2-methyl-1<i>H</i>-imidazol-1-yl)pentane and 5-methylisophthalate ligands
Acta Crystallographica Section C, 2017, 73, 78-83
2020713 CIF
HKL
C28 H28 Cu N10 O7P -110.174; 12.538; 13.665
63.45; 77.06; 73.02
1482.4Li, Jian-Hua; Zhu, Meng-Di; Huang, Qiu-Ying
A new one-dimensional Cu^II^ complex with a three-dimensional supramolecular architecture incorporating benzene-1,3-dicarboxylate and 1-[(1<i>H</i>-benzotriazol-1-yl)methyl]-1<i>H</i>-imidazole
Acta Crystallographica Section C, 2017, 73, 91-96
2020714 CIFCr D20 N2 O14 S2P 1 21/a 19.488; 12.816; 6.097
90; 107.11; 90
708.6Figgis, Brian N.; Kucharski, Edward S.; Forsyth, J. Bruce
The structure of (ND4)2Cr(SO4)2.6D2O at 4.3 K by neutron diffraction
Acta Crystallographica Section C, 1991, 47, 419-421
2020715 CIF
HKL
C20 H21 N2 O PP n a 2117.4366; 22.7127; 8.8598
90; 90; 90
3508.77Hamzehee, Farahnaz; Pourayoubi, Mehrdad; Nečas, Marek; Choquesillo-Lazarte, Duane
Extensive analysis of N—H···O hydrogen bonding in four classes of phosphorus compounds: a combined experimental and database study
Acta Crystallographica Section C, 2017, 73
2020716 CIF
HKL
C16 H20 N O PP -4 21 c18.7952; 18.7952; 8.5279
90; 90; 90
3012.56Hamzehee, Farahnaz; Pourayoubi, Mehrdad; Nečas, Marek; Choquesillo-Lazarte, Duane
Extensive analysis of N—H···O hydrogen bonding in four classes of phosphorus compounds: a combined experimental and database study
Acta Crystallographica Section C, 2017, 73
2020717 CIF
HKL
C22 H27 N2 O2 PP 21 21 215.3629; 13.726; 27.8653
90; 90; 90
2051.2Hamzehee, Farahnaz; Pourayoubi, Mehrdad; Nečas, Marek; Choquesillo-Lazarte, Duane
Extensive analysis of N—H···O hydrogen bonding in four classes of phosphorus compounds: a combined experimental and database study
Acta Crystallographica Section C, 2017, 73
2020718 CIF
HKL
C20 H22 N O2 PP 1 21/c 16.0483; 18.854; 15.4364
90; 97.231; 90
1746.28Hamzehee, Farahnaz; Pourayoubi, Mehrdad; Nečas, Marek; Choquesillo-Lazarte, Duane
Extensive analysis of N—H···O hydrogen bonding in four classes of phosphorus compounds: a combined experimental and database study
Acta Crystallographica Section C, 2017, 73
2020719 CIF
HKL
Paper
C54 H45 Cu F6 N5 P3P 1 21/n 113.0725; 12.3992; 30.0047
90; 99.734; 90
4793.4Báez-Castro, Alberto; Baldenebro-López, Jesús; Ceballos-Mendivil, Laura; Román-Bravo, Perla P.; Höpfl, Herbert; Miranda-Soto, Valentín; Glossman-Mitnik, Daniel; Cruz-Enríquez, Adriana; Campos-Gaxiola, José J.
Synthesis, crystal structure, DFT studies and photophysical properties of a copper(I)‒triphenylphosphane complex based on <i>trans</i>-(±)-2,4,5-tris(pyridin-2-yl)-2-imidazoline
Acta Crystallographica Section C, 2017, 73
2020720 CIF
HKL
Paper
C21 H19 F4 N3 O2 SP b c a19.7282; 9.7644; 20.7157
90; 90; 90
3990.5Sagar, Belakavadi K.; Harsha, Kachigere B.; Yathirajan, Hemmige S.; Rangappa, Kanchugarakoppal S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 4,5,6,7-tetrahydro-1<i>H</i>-pyrazolo[4,3-<i>c</i>]pyridines: synthesis, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2017, 73, 298-304
2020721 CIF
HKL
Paper
C21 H19 Cl F3 N3 O2 SP 21 21 215.4468; 11.4102; 34.3009
90; 90; 90
2131.77Sagar, Belakavadi K.; Harsha, Kachigere B.; Yathirajan, Hemmige S.; Rangappa, Kanchugarakoppal S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 4,5,6,7-tetrahydro-1<i>H</i>-pyrazolo[4,3-<i>c</i>]pyridines: synthesis, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2017, 73, 298-304
2020722 CIF
HKL
Paper
C22 H22 F3 N3 O2 SP 1 21/n 113.8408; 8.7145; 18.0898
90; 106.47; 90
2092.4Sagar, Belakavadi K.; Harsha, Kachigere B.; Yathirajan, Hemmige S.; Rangappa, Kanchugarakoppal S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 4,5,6,7-tetrahydro-1<i>H</i>-pyrazolo[4,3-<i>c</i>]pyridines: synthesis, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2017, 73, 298-304
2020723 CIF
HKL
Paper
C19 H13 F OP -17.6678; 11.5007; 15.7874
96.249; 96.752; 90.796
1373.84Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 1-(naphthalen-2-yl)prop-2-en-1-ones: pseudosymmetry, disorder and supramoleular assembly mediated by C—H···π and C—Br···π interactions
Acta Crystallographica Section C, 2017, 73, 115-120
2020724 CIF
HKL
Paper
C19 H13 Br OP -15.8714; 7.8616; 15.5954
95.007; 90.218; 92.179
716.58Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 1-(naphthalen-2-yl)prop-2-en-1-ones: pseudosymmetry, disorder and supramoleular assembly mediated by C—H···π and C—Br···π interactions
Acta Crystallographica Section C, 2017, 73, 115-120
2020725 CIF
HKL
Paper
C17 H12 O SP -15.8271; 7.4489; 15.2068
79.745; 84.427; 85.763
645.36Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Three closely related 1-(naphthalen-2-yl)prop-2-en-1-ones: pseudosymmetry, disorder and supramoleular assembly mediated by C—H···π and C—Br···π interactions
Acta Crystallographica Section C, 2017, 73, 115-120
2020726 CIF
HKL
Paper
C20 H34 Cl6 Co3 N6 O2P -17.7669; 9.1516; 12.4114
99.665; 104.29; 93.968
837.1Stinghen, Danilo; Rüdiger, André Luis; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L.
Cobalt(II) chloride adducts with acetonitrile, propan-2-ol and tetrahydrofuran: considerations on nuclearity, reactivity and synthetic applications
Acta Crystallographica Section C, 2017, 73, 104-114
2020727 CIF
HKL
Paper
C12 H32 Cl4 Co2 O4C 1 2/c 116.5619; 9.4778; 15.6842
90; 116.411; 90
2205Stinghen, Danilo; Rüdiger, André Luis; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L.
Cobalt(II) chloride adducts with acetonitrile, propan-2-ol and tetrahydrofuran: considerations on nuclearity, reactivity and synthetic applications
Acta Crystallographica Section C, 2017, 73, 104-114
2020728 CIF
HKL
Paper
C16 H32 Cl4 Co2 O4P 1 21/c 114.733; 9.6318; 15.993
90; 93.737; 90
2264.7Stinghen, Danilo; Rüdiger, André Luis; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L.
Cobalt(II) chloride adducts with acetonitrile, propan-2-ol and tetrahydrofuran: considerations on nuclearity, reactivity and synthetic applications
Acta Crystallographica Section C, 2017, 73, 104-114
2020729 CIF
HKL
Paper
C6 H14 N2 O4 SP 1 21/c 110.9626; 10.2601; 8.7673
90; 91.421; 90
985.82Gomathi, V.; Theivarasu, C.
Hydrogen-bonded assemblies in the molecular crystals of 2,2'-thiodiacetic acid with ethylenediamine and <i>o</i>-phenylenediamine
Acta Crystallographica Section C, 2017, 73, 97-103
2020730 CIF
HKL
Paper
C10 H14 N2 O4 SP 1 21/n 14.9006; 12.9808; 18.9837
90; 92.978; 90
1205.99Gomathi, V.; Theivarasu, C.
Hydrogen-bonded assemblies in the molecular crystals of 2,2'-thiodiacetic acid with ethylenediamine and <i>o</i>-phenylenediamine
Acta Crystallographica Section C, 2017, 73, 97-103
2020731 CIF
HKL
Paper
Cd23 Ce6 TeF m -3 m14.1632; 14.1632; 14.1632
90; 90; 90
2841.08Desroches, Griffen; Bobev, Svilen
Synthesis and structure determination of Ce~6~Cd~23~Te: a new chalcogen-containing member of the <i>RE</i>~6~Cd~23~T family (<i>RE</i> is a rare-earth metal and T is a late group 14, 15 and 16 element)
Acta Crystallographica Section C, 2017, 73, 121-125
2020732 CIF
HKL
Paper
C25.5 H28 N2 O7 SP 41 21 212.98; 12.98; 29.734
90; 90; 90
5009.6Wu, Yun-Deng; Zhang, Xiao-Lei; Liu, Xiao-Hong; Xu, Jian; Zhang, Mei; Shen, Kun; Zhang, Si-Han; He, Yong-Mei; Ma, Yan; Zhang, Ai-Hua
The preparation, characterization, structure and dissolution analysis of apremilast solvatomorphs
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020733 CIF
HKL
Paper
C23 H26 Cl2 N2 O7 SP 41 21 213.171; 13.171; 29.524
90; 90; 90
5122Wu, Yun-Deng; Zhang, Xiao-Lei; Liu, Xiao-Hong; Xu, Jian; Zhang, Mei; Shen, Kun; Zhang, Si-Han; He, Yong-Mei; Ma, Yan; Zhang, Ai-Hua
The preparation, characterization, structure and dissolution analysis of apremilast solvatomorphs
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020734 CIF
HKL
Paper
C24 H28 N2 O8 SP 41 21 213.0307; 13.0307; 29.754
90; 90; 90
5052.2Wu, Yun-Deng; Zhang, Xiao-Lei; Liu, Xiao-Hong; Xu, Jian; Zhang, Mei; Shen, Kun; Zhang, Si-Han; He, Yong-Mei; Ma, Yan; Zhang, Ai-Hua
The preparation, characterization, structure and dissolution analysis of apremilast solvatomorphs
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020735 CIF
HKL
C20 H18 Br2 Hg N10P b c n11.756; 11.764; 17.407
90; 90; 90
2407.3Wei, Xu; Li, Jian-Hua; Huang, Qiu-Ying; Meng, Xiang-Ru
Two new isostructural mercury(II) complexes involving the N-heterocyclic 1-[(benzotriazol-1-yl)methyl]-1<i>H</i>-1,3-imidazole ligand: syntheses, structures and properties
Acta Crystallographica Section C, 2017, 73
2020736 CIF
HKL
C20 H18 Hg I2 N10P b c n12.103; 11.827; 17.862
90; 90; 90
2556.8Wei, Xu; Li, Jian-Hua; Huang, Qiu-Ying; Meng, Xiang-Ru
Two new isostructural mercury(II) complexes involving the N-heterocyclic 1-[(benzotriazol-1-yl)methyl]-1<i>H</i>-1,3-imidazole ligand: syntheses, structures and properties
Acta Crystallographica Section C, 2017, 73
2020737 CIF
HKL
Paper
C30 H18 N4 SP 18.3617; 8.7261; 8.859
104.451; 94.187; 112.344
568.69Averkiev, Boris B.; Davydenko, Iryna; Wang, Xu; Barlow, Stephen; Marder, Seth R.
Crystal structure of 5,6-bis(9<i>H</i>-carbazol-9-yl)benzo[<i>c</i>][1,2,5]thiadiazole: distortion from a hypothetical higher-symmetry structure
Acta Crystallographica Section C, 2017, 73, 319-324
2020738 CIF
Paper
C30 H18.25 N4 O0.12 SC 1 2/c 128.338; 12.9466; 26.799
90; 113.336; 90
9027.8Averkiev, Boris B.; Davydenko, Iryna; Wang, Xu; Barlow, Stephen; Marder, Seth R.
Crystal structure of 5,6-bis(9<i>H</i>-carbazol-9-yl)benzo[<i>c</i>][1,2,5]thiadiazole: distortion from a hypothetical higher-symmetry structure
Acta Crystallographica Section C, 2017, 73, 319-324
2020740 CIF
HKL
Paper
C6 H9 As Cl N O3P 1 21/c 116.6534; 7.4129; 7.6073
90; 97.795; 90
930.44Smith, Graham; Wermuth, Urs D.
Unusual 4-arsonoanilinium cationic species in the hydrochloride salt of (4-aminophenyl)arsonic acid and formed in the reaction of the acid with copper(II) sulfate, copper(II) chloride and cadmium chloride
Acta Crystallographica Section C, 2017, 73
2020741 CIF
HKL
Paper
C12 H34 As2 Cu N2 O22 S2P 1 21/c 115.0784; 11.2302; 8.6756
90; 99.305; 90
1449.74Smith, Graham; Wermuth, Urs D.
Unusual 4-arsonoanilinium cationic species in the hydrochloride salt of (4-aminophenyl)arsonic acid and formed in the reaction of the acid with copper(II) sulfate, copper(II) chloride and cadmium chloride
Acta Crystallographica Section C, 2017, 73
2020742 CIF
HKL
Paper
C12 H18 As2 Cl4 Cu N2 O6P b c a7.6315; 7.1244; 38.0925
90; 90; 90
2071.08Smith, Graham; Wermuth, Urs D.
Unusual 4-arsonoanilinium cationic species in the hydrochloride salt of (4-aminophenyl)arsonic acid and formed in the reaction of the acid with copper(II) sulfate, copper(II) chloride and cadmium chloride
Acta Crystallographica Section C, 2017, 73
2020743 CIF
HKL
Paper
C12 H18 As2 Cd Cl4 N2 O6P b c a7.5525; 7.2578; 38.5872
90; 90; 90
2115.14Smith, Graham; Wermuth, Urs D.
Unusual 4-arsonoanilinium cationic species in the hydrochloride salt of (4-aminophenyl)arsonic acid and formed in the reaction of the acid with copper(II) sulfate, copper(II) chloride and cadmium chloride
Acta Crystallographica Section C, 2017, 73
2020745 CIF
HKL
Paper
C9 H10 Cl F4 N OP 1 21/c 14.7874; 8.2086; 27.2894
90; 92.803; 90
1071.13Lu, Norman; Wei, Rong-Jyun; Lin, Kwan-Yu; Alagesan, Mani; Wen, Yuh-Sheng; Liu, Ling-Kang
Weak hydrogen bonding and fluorous interactions in the chloride and bromide salts of 4-[(2,2,3,3-tetrafluoropropoxy)methyl]pyridinium
Acta Crystallographica Section C, 2017, 73
2020746 CIF
HKL
C9 H10 Br F4 N OP 1 21/c 14.7977; 8.3123; 27.739
90; 92.646; 90
1105.05Lu, Norman; Wei, Rong-Jyun; Lin, Kwan-Yu; Alagesan, Mani; Wen, Yuh-Sheng; Liu, Ling-Kang
Weak hydrogen bonding and fluorous interactions in the chloride and bromide salts of 4-[(2,2,3,3-tetrafluoropropoxy)methyl]pyridinium
Acta Crystallographica Section C, 2017, 73
2020747 CIF
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Al4 Li9 Sn5P -3 m 14.717; 4.717; 17.077
90; 90; 120
329.06Pavlyuk, Volodymyr; Dmytriv, Grygoriy; Tarasiuk, Ivan; Ehrenberg, Helmut
Li~9~Al~4~Sn~5~ as a new ordered superstructure of the Li~13~Sn~5~ type
Acta Crystallographica Section C, 2017, 73
2020748 CIF
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Paper
C15 H8 Cl Mn N2 O3 SP 1 21/c 115.008; 11.798; 9.0384
90; 106.756; 90
1532.4Stenger-Smith, Jenny; Chakraborty, Indranil; Carrington, Samantha; Mascharak, Pradip
Synthesis and structures of photoactive manganese‒carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole and 2-(quinolin-2-yl)-1,3-benzothiazole
Acta Crystallographica Section C, 2017, 73
2020749 CIF
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C19 H10 Cl Mn N2 O3 SP 1 21/n 19.1239; 16.4292; 12.2101
90; 96.737; 90
1817.64Stenger-Smith, Jenny; Chakraborty, Indranil; Carrington, Samantha; Mascharak, Pradip
Synthesis and structures of photoactive manganese‒carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole and 2-(quinolin-2-yl)-1,3-benzothiazole
Acta Crystallographica Section C, 2017, 73
2020750 CIFF6 H8 N2 ZrP c a 2113.398; 7.739; 11.68
90; 90; 90
1211.1A. Zalkin; D. Eimerl; S. P. Velsko
Diammonium hexafluorozirconate
Acta Crystallographica, Section C, 1988, 44, 2050-2051
2020757 CIF
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Paper
C14 H36 Cl2 Co N4 O2P 1 21/c 18.2864; 17.0679; 13.9733
90; 90.735; 90
1976.1Van Heuvelen, Katherine M.; Lee, Isabell; Arriola, Katherine; Griffin, Rilke; Ye, Christopher; Takase, Michael K.
Crystal structure and spectroscopic characterization of a cobalt(II) tetraazamacrocycle: completing a series of first-row transition-metal complexes
Acta Crystallographica Section C, 2017, 73
2020758 CIF
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Paper
C16 H14 B Li O7P 1 21 16.5592; 9.1328; 13.7163
90; 93.9; 90
819.76Wong, Lawrence W.-Y.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Williams, Ian D.
Chiral bis(mandelato)borate salts for resolution <i>via</i> metathesis crystallization
Acta Crystallographica Section C, 2017, 73
2020759 CIF
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Paper
C16 H16 B N O6P 1 21 17.49015; 8.24219; 13.275
90; 92.8753; 90
818.5Wong, Lawrence W.-Y.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Williams, Ian D.
Chiral bis(mandelato)borate salts for resolution <i>via</i> metathesis crystallization
Acta Crystallographica Section C, 2017, 73
2020760 CIF
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Paper
C32 H48 B N O6P 21 21 219.0372; 15.5934; 44.5357
90; 90; 90
6276Wong, Lawrence W.-Y.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Williams, Ian D.
Chiral bis(mandelato)borate salts for resolution <i>via</i> metathesis crystallization
Acta Crystallographica Section C, 2017, 73
2020761 CIF
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Paper
C16 H20 Br2 Cu N4 O2P -19.0673; 10.1144; 11.7417
69.013; 77.791; 81.901
980.2Smolentsev, Anton I.
Copper(II) bromide, nitrate and perchlorate complexes with sterically demanding <i>N</i>-(6-methylpyridin-2-yl)acetamide ligands
Acta Crystallographica Section C, 2017, 73
2020762 CIF
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Paper
C16 H22 Cu N6 O9P b c n13.3089; 8.4494; 18.535
90; 90; 90
2084.3Smolentsev, Anton I.
Copper(II) bromide, nitrate and perchlorate complexes with sterically demanding <i>N</i>-(6-methylpyridin-2-yl)acetamide ligands
Acta Crystallographica Section C, 2017, 73
2020763 CIF
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Paper
C16 H22 Cl2 Cu N4 O11C 1 2/c 118.7332; 8.2315; 15.7876
90; 109.1; 90
2300.46Smolentsev, Anton I.
Copper(II) bromide, nitrate and perchlorate complexes with sterically demanding <i>N</i>-(6-methylpyridin-2-yl)acetamide ligands
Acta Crystallographica Section C, 2017, 73
2020764 CIF
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Paper
C18 H21 N3 O15 S2C 1 2/c 119.951; 11.7885; 20.891
90; 105.625; 90
4731.8Truong, Khai-Nghi; Lothmann, Niklas; Englert, Ulli
A whole zoo of hydrogen bonds in one crystal structure: tris(isonicotinium) hydrogensulfate sulfate monohydrate
Acta Crystallographica Section C, 2017, 73, 525-530
2020765 CIF
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Paper
C12 H10 Cl N5 O6P -17.1403; 8.6745; 11.573
93.721; 93.714; 104.23
690.94Mohana, Marimuthu; Thomas Muthiah, Packianathan; Butcher, Ray J.
Supramolecular interactions in carboxylate and sulfonate salts of 2,6-diamino-4-chloropyrimidinium
Acta Crystallographica Section C, 2017, 73, 536-540
2020766 CIF
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Paper
C11 H15 Cl N4 O4 SP -16.54; 7.2557; 15.7696
81.617; 89.511; 74.154
711.79Mohana, Marimuthu; Thomas Muthiah, Packianathan; Butcher, Ray J.
Supramolecular interactions in carboxylate and sulfonate salts of 2,6-diamino-4-chloropyrimidinium
Acta Crystallographica Section C, 2017, 73, 536-540
2020767 CIF
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Paper
C12 H11 F N2 O4P 1 21/c 113.6345; 6.9015; 12.6905
90; 105.429; 90
1151.1Mohana, Marimuthu; Muthiah, Packianathan Thomas; McMillen, Colin D.
Supramolecular hydrogen-bonding patterns in 1:1 cocrystals of 5-fluorouracil with 4-methylbenzoic acid and 3-nitrobenzoic acid
Acta Crystallographica Section C, 2017, 73, 259-263
2020768 CIF
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C11 H8 F N3 O6P -15.9011; 9.795; 11.674
110.76; 91.84; 99.59
619.1Mohana, Marimuthu; Muthiah, Packianathan Thomas; McMillen, Colin D.
Supramolecular hydrogen-bonding patterns in 1:1 cocrystals of 5-fluorouracil with 4-methylbenzoic acid and 3-nitrobenzoic acid
Acta Crystallographica Section C, 2017, 73, 259-263
2020769 CIF
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Paper
C10 H30 Mn N6 O4P -18.386; 9.1422; 12.9405
69.526; 87.16; 76.788
904.33Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020770 CIF
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C10 H30 Fe N6 O4P -18.3426; 9.1332; 12.8165
70.423; 86.074; 75.628
891.19Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020771 CIF
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C10 H30 Co N6 O4P -18.3029; 9.1295; 12.7175
71.021; 85.776; 75.146
881.08Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020772 CIF
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C10 H30 N6 Ni O4P -18.2974; 9.0619; 12.5998
71.96; 85.204; 74.321
867.3Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020773 CIF
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C10 H30 Cu N6 O4P -18.2953; 8.9144; 12.7148
75.244; 85.082; 71.226
860.84Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020774 CIF
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C10 H30 N6 O4 ZnP -18.3223; 9.1059; 12.7492
70.855; 85.8; 75.434
883.34Pham, Duyen N. K.; Roy, Mrittika; Golen, James A.; Manke, David R.
The first-row transition-metal series of tris(ethylenediamine) diacetate complexes [<i>M</i>(en)~3~](OAc)~2~ (<i>M</i> is Mn, Fe, Co, Ni, Cu, and Zn)
Acta Crystallographica Section C, 2017, 73, 442-446
2020775 CIF
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Paper
C62 H40 Mg N6 O18P -19.2595; 10.2711; 16.0049
96.056; 92.679; 115.714
1356.47Liu, Jian-Jun; Liu, Teng; Huang, Chang-Cang
Synthesis and characterization of a photochromic magnesium(II) coordination polymer based on a naphthalene diimide ligand
Acta Crystallographica Section C, 2017, 73, 437-441
2020776 CIF
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Paper
C62 H58 Cl2 Co2 N6 O18 P2P 1 21/c 111.0638; 14.0258; 20.8917
90; 101.59; 90
3175.84Anjana, S. S.; Varghese, Babu; Prasad, Edamana
Dinuclear cobalt(II) complexes with double phosphate ester bridges and tetradentate ligands having anisole or quinoline appendages
Acta Crystallographica Section C, 2017, 73, 492-497
2020777 CIF
HKL
Paper
C66 H56 Cl2 Co2 N8 O16 P2P 1 21/c 113.0021; 12.8075; 19.8373
90; 93.008; 90
3298.84Anjana, S. S.; Varghese, Babu; Prasad, Edamana
Dinuclear cobalt(II) complexes with double phosphate ester bridges and tetradentate ligands having anisole or quinoline appendages
Acta Crystallographica Section C, 2017, 73, 492-497
2020778 CIF
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Paper
C90 H68 Ca O29 Zn6I 41/a33.1506; 33.1506; 16.6829
90; 90; 90
18333.9Guo, Pei-Ying; Ma, De-Yun; Guo, Hai-Fu
A twofold interpenetrating three-dimensional heterometallic metal‒organic framework with pcu topology based on 2-methylbiphenyl-4,4'-dicarboxylic acid
Acta Crystallographica Section C, 2017, 73, 470-475
2020779 CIF
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Paper
C18 H26 Ag2 N10 O6 S3P 1 21/n 18.3665; 23.1277; 13.5984
90; 98.221; 90
2604.2Fu, Wei-Wei; Li, Juan; Liu, Shu-Ting; Zhao, Dan; Zhou, Xue; Tong, Yang
A one-dimensional silver(I) coordination polymer based on 5-methyl-1,3,4-thiadiazol-2-amine and pyridine-2,3-dicarboxylate
Acta Crystallographica Section C, 2017, 73, 498-502
2020780 CIF
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Paper
C24 H10 Cd F10 N2 O5P 1 21/c 112.9134; 21.035; 9.1946
90; 93.696; 90
2492.4Kong, Ya-Jie; Li, Peng; Han, Li-Juan; Fan, Lu-Tong; Li, Peng-Peng; Yin, Shuang
Two cadmium(II) fluorous coordination compounds tuned by different bipyridines
Acta Crystallographica Section C, 2017, 73, 424-429
2020781 CIF
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Paper
C24 H12 Cd F10 N2 O6C 1 2/c 121.402; 11.711; 10.955
90; 106.639; 90
2630.8Kong, Ya-Jie; Li, Peng; Han, Li-Juan; Fan, Lu-Tong; Li, Peng-Peng; Yin, Shuang
Two cadmium(II) fluorous coordination compounds tuned by different bipyridines
Acta Crystallographica Section C, 2017, 73, 424-429
2020782 CIF
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Paper
C10 H28 Cu N2 O8P 1 21/c 115.7523; 7.1201; 15.954
90; 112.709; 90
1650.65Şen, Fatih; Kansiz, Sevgi; Uçar, İbrahim
A one-dimensional copper(II) coordination polymer incorporating succinate and <i>N</i>,<i>N</i>-diethylethylenediamine ligands: crystallographic analysis, vibrational and surface features, and DFT analysis
Acta Crystallographica Section C, 2017, 73, 517-524
2020783 CIF
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Paper
C20 H20 N2 O4P 1 21 15.3048; 31.891; 10.508
90; 98.184; 90
1759.6Kerr, Hannah E.; Softley, Lorna K.; Suresh, Kuthuru; Hodgkinson, Paul; Evans, Ivana Radosavljevic
Structure and physicochemical characterization of a naproxen‒picolinamide cocrystal
Acta Crystallographica Section C, 2017, 73, 168-175
2020784 CIF
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Paper
C26 H17 N5 O2 S2P 1 21/n 17.1707; 22.8006; 13.8237
90; 97.047; 90
2243.05Pöppler, Ann-Christin; Corlett, Emily K.; Pearce, Harriet; Seymour, Mark P.; Reid, Matthew; Montgomery, Mark G.; Brown, Steven P.
Single-crystal X-ray diffraction and NMR crystallography of a 1:1 cocrystal of dithianon and pyrimethanil
Acta Crystallographica Section C, 2017, 73, 149-156
2020785 CIF
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C13 H13 Cl2 N5 O2I 41/a19.513; 19.513; 17.613
90; 90; 90
6706Freire, Eleonora; Echeverría, Gustavo A.; Baggio, Ricardo
Lamotriginium crotonate and lamotriginium salicylate ethanol monosolvate: the role of solvent molecules in the packing organization
Acta Crystallographica Section C, 2017, 73, 563-568
2020786 CIF
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C18 H19 Cl2 N5 O4P -17.9389; 12.2938; 12.3282
61.781; 79.379; 72.313
1008.91Freire, Eleonora; Echeverría, Gustavo A.; Baggio, Ricardo
Lamotriginium crotonate and lamotriginium salicylate ethanol monosolvate: the role of solvent molecules in the packing organization
Acta Crystallographica Section C, 2017, 73, 563-568
2020787 CIF
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Paper
C49 H41 Cu F6 N O2 P3P 1 21/n 110.5376; 21.5025; 19.9462
90; 99.079; 90
4462.9Shou, Rong-Er; Song, Li; Chai, Wen-Xiang; Qin, Lai-Shun; Wang, Tian-Gen
A new phosphorescent heteroleptic cuprous complex with a neutral 2-methylquinolin-8-ol ligand: synthesis, structure characterization, properties and TD‒DFT calculations
Acta Crystallographica Section C, 2017, 73, 486-491
2020788 CIF
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Paper
C44 H52 Cu4 N4 O12P 1 21/c 116.2592; 14.2078; 9.256
90; 92.527; 90
2136.13Gungor, Elif
A new stepped tetranuclear copper(II) complex: synthesis, crystal structure and photoluminescence properties
Acta Crystallographica Section C, 2017, 73, 393-398
2020789 CIF
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Paper
C18 H12 N2 OP 1 21/c 113.304; 5.1796; 19.6396
90; 95.143; 90
1347.9Su, Yan-Xiao; Zhang, Chao-Zhi; Song, Ming-Xia
Optical properties of (<i>Z</i>)-2-(2-phenylhydrazinylidene)acenaphthen-1(2<i>H</i>)-one: a potential electron donor in organic solar cells
Acta Crystallographica Section C, 2017, 73, 458-463
2020790 CIF
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Paper
C3 H18 F6 N9 VP a -314.095; 14.095; 14.095
90; 90; 90
2800.2Black, Cameron; Lightfoot, Philip
Crystal structure of guanidinium hexafluoridovanadate(III), (CN~3~H~6~)~3~[VF~6~]: an unusual hybrid compound related to perovskite
Acta Crystallographica Section C, 2017, 73, 244-246
2020791 CIF
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Paper
C32 H22 N4 O4 S4P 1 2/c 113.1813; 7.2661; 15.6283
90; 96.933; 90
1485.88Zarei, Seyed Amir; Piltan, Mohammad; Mashhun, Asmar; Rudbari, Hadi Amiri; Bruno, Giuseppe
2,2'-[(Disulfanediyl)bis{5-[(1<i>E</i>)-(2-hydroxybenzylidene)amino]-1,3-thiazole-4,2-diyl}]diphenol: synthesis, crystal structure and calculation of molecular hyperpolarizability
Acta Crystallographica Section C, 2017, 73
2020792 CIF
HKL
Paper
C16 H14 F4 N2 O4 SP -17.0975; 7.9093; 16.9976
86.16; 83.141; 66.564
869Lu, Norman; Chiang, Hsing-Fang; Wei, Rong-Jyun; Wen, Yuh-Sheng; Liu, Ling-Kang
Molecular structures of 3-[(2,2,3,3-tetrafluoropropoxy)methyl]- and 3-[(2,2,3,3,3-pentafluoropropoxy)methyl]pyridinium saccharinates
Acta Crystallographica Section C, 2017, 73
2020793 CIF
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C16 H13 F5 N2 O4 SI -421.6747; 21.6747; 7.285
90; 90; 90
3422.44Lu, Norman; Chiang, Hsing-Fang; Wei, Rong-Jyun; Wen, Yuh-Sheng; Liu, Ling-Kang
Molecular structures of 3-[(2,2,3,3-tetrafluoropropoxy)methyl]- and 3-[(2,2,3,3,3-pentafluoropropoxy)methyl]pyridinium saccharinates
Acta Crystallographica Section C, 2017, 73
2020794 CIF
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Paper
C22 H28 N2 O4P 21 21 215.0591; 16.7533; 23.5587
90; 90; 90
1996.76Georgilis, Evangelos; Gessmann, Renate; Mitraki, Anna; Petratos, Kyriacos
Diphenylalanine in tetrahydrofuran: a highly potent candidate for the development of novel nanomaterials
Acta Crystallographica Section C, 2017, 73, 447-450
2020795 CIF
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C22 H28 N2 O4P 21 21 215.0827; 16.7903; 24.0532
90; 90; 90
2052.7Georgilis, Evangelos; Gessmann, Renate; Mitraki, Anna; Petratos, Kyriacos
Diphenylalanine in tetrahydrofuran: a highly potent candidate for the development of novel nanomaterials
Acta Crystallographica Section C, 2017, 73, 447-450
2020796 CIF
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Paper
C27 H25 N5P 1 21/c 18.1493; 8.5209; 34.4887
90; 96.648; 90
2378.8Bu, Fan-Zhi; Tan, Xue-Jie; Xing, Dian-Xiang; Wang, Chao
Design, synthesis, crystal structure and <i>in vitro</i> cytotoxic properties of a novel Schiff base derived from indole and biphenyl
Acta Crystallographica Section C, 2017, 73, 546-555
2020797 CIF
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Paper
C24 H32 Cl2 O2 Sc2P 1 21/n 19.3324; 10.754; 12.2892
90; 111.349; 90
1148.72Zhou, Zheng; Greenough, Joshua; Wei, Zheng; Petrukhina, Marina A.
The dinuclear scandium(III) cyclooctatetraenyl chloride complex di-μ-chlorido-bis[(η^8^-cyclooctatetraene)(tetrahydrofuran-κ<i>O</i>)scandium(III)]
Acta Crystallographica Section C, 2017, 73, 420-423
2020798 CIF
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Paper
C33 H27 Br O6P -18.4269; 12.4905; 15.1415
66.53; 76.005; 85.473
1418.22Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020799 CIF
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Paper
C34 H29 Br O6P -18.3989; 12.5415; 15.2195
67.408; 76.135; 85.458
1436.85Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020800 CIF
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Paper
C35 H31 Br O6P -18.2587; 12.7841; 15.6238
66.446; 76.634; 86.03
1470.67Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan; Karthik, Govindaraju; Reddy, Basi Venkata Subba
Three isostructural solvates of a tetrahydrofurochromenone derivative
Acta Crystallographica Section C, 2017, 73, 407-413
2020801 CIF
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Paper
C8 H20 Mn O18 UP -16.997; 7.185; 11.043
106.356; 93.891; 115.13
470.9Ridenour, J. August; Pyrch, Mikaela M.; Manning, Zachery J.; Bertke, Jeffery A.; Cahill, Christopher L.
Two novel bimetallic transition metal‒uranyl one-dimensional coordination polymers with manganese(II) and cobalt(II) incorporating bridging diglycolate (2,2′-oxydiacetate) ligands
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020802 CIFC8 H20 Co O18 UP -16.997; 7.185; 11.043
106.356; 93.891; 115.13
470.9Ridenour, J. August; Pyrch, Mikaela M.; Manning, Zachery J.; Bertke, Jeffery A.; Cahill, Christopher L.
Two novel bimetallic transition metal‒uranyl one-dimensional coordination polymers with manganese(II) and cobalt(II) incorporating bridging diglycolate (2,2′-oxydiacetate) ligands
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020803 CIF
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Paper
C22 H30 O9P 21 21 219.1605; 13.8069; 16.8625
90; 90; 90
2132.74Paz, Cristian; von Dossow, Daniela; Tiznado, Victor; Suarez, Sebastián; Cukiernik, Fabio D.; Baggio, Ricardo
A dihydro-β-agarofuran sesquiterpene from <i>Maytenus boaria</i>
Acta Crystallographica Section C, 2017, 73, 451-457
2020804 CIF
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Paper
H20 Mg Na2 O18 Se2P 1 21/c 112.671; 6.61; 10.2706
90; 106.64; 90
824.19Kamburov, Stoyan; Schmidt, Horst; Voigt, Wolfgang; Balarew, Christo
Crystal structures of sodium magnesium selenate decahydrate, Na~2~Mg(SeO~4~)~2~·10H~2~O, a new selenate salt, and sodium magnesium selenate dihydrate, Na~2~Mg(SeO~4~)~2~·2H~2~O
Acta Crystallographica Section C, 2017, 73, 582-587
2020805 CIF
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Paper
H4 Mg Na2 O10 Se2P -15.556; 5.923; 7.224
108.36; 99.07; 106.63
208Kamburov, Stoyan; Schmidt, Horst; Voigt, Wolfgang; Balarew, Christo
Crystal structures of sodium magnesium selenate decahydrate, Na~2~Mg(SeO~4~)~2~·10H~2~O, a new selenate salt, and sodium magnesium selenate dihydrate, Na~2~Mg(SeO~4~)~2~·2H~2~O
Acta Crystallographica Section C, 2017, 73, 582-587
2020806 CIF
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Paper
C27 H32 N2 O3P 21 21 219.9801; 18.854; 26.1414
90; 90; 90
4918.9Kramer, Philipp; Bolte, Michael
Synthesis and crystal structures of two structurally related kryptoracemates
Acta Crystallographica Section C, 2017, 73, 575-581
2020807 CIF
HKL
Paper
C25.5 H29 Cl N2 O3P 110.1501; 14.8556; 17.662
109.248; 97.929; 91.214
2483.9Kramer, Philipp; Bolte, Michael
Synthesis and crystal structures of two structurally related kryptoracemates
Acta Crystallographica Section C, 2017, 73, 575-581
2020808 CIF
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Paper
C9 H6 Br F N2 O4 SP -16.8884; 9.5036; 9.618
73.608; 87.634; 69.969
566.43Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D.
Supramolecular architectures in two 1:1 cocrystals of 5-fluorouracil with 5-bromothiophene-2-carboxylic acid and thiophene-2-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 481-485
2020809 CIF
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Paper
C9 H7 F N2 O4 SP -16.8304; 7.0075; 12.3042
93.348; 103.091; 115.566
509.22Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D.
Supramolecular architectures in two 1:1 cocrystals of 5-fluorouracil with 5-bromothiophene-2-carboxylic acid and thiophene-2-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 481-485
2020810 CIF
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Paper
C49 H37 Cl7 N4 O4 S4P -110.242; 11.807; 22.297
80.453; 84.916; 64.733
2404.1Wickham, Laura M.; Tanski, Joseph M.; Nadeau, Jocelyn M.
Crystal structure of a fluorescent C-shaped molecule containing closely stacked bithiophene-substituted quinoxaline rings
Acta Crystallographica Section C, 2017, 73, 276-279
2020811 CIF
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Paper
C46 H40 Cl2 Co N16 O10P 1 21/n 19.54931; 16.1513; 14.5715
90; 91.2561; 90
2246.88Wang, Xue-Ru; Ma, Jian-Ping; Dong, Yu-Bin
Syntheses and structures of two new coordination polymers generated from a 4-aminotriazole-bridged organic ligand and Co^II^ salts
Acta Crystallographica Section C, 2017, 73, 247-253
2020812 CIF
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C22 H16 Cl2 Co N8P 1 21/c 120.4923; 7.4278; 13.9819
90; 94.891; 90
2120.47Wang, Xue-Ru; Ma, Jian-Ping; Dong, Yu-Bin
Syntheses and structures of two new coordination polymers generated from a 4-aminotriazole-bridged organic ligand and Co^II^ salts
Acta Crystallographica Section C, 2017, 73, 247-253
2020813 CIF
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C14 H21 N O4P 1 21 18.7136; 6.3606; 13.3613
90; 100.22; 90
728.78Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020814 CIF
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C14 H21 N O4P 1 21 18.7007; 6.3466; 13.3458
90; 100.243; 90
725.21Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020815 CIF
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C32 H55 O5.5C 1 2 129.0091; 7.7205; 29.9984
90; 114.524; 90
6112.5Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020816 CIF
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C33 H57 O5.5P 1 21 117.9895; 8.2912; 22.7981
90; 108.343; 90
3227.7Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020817 CIF
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C32 H54 O5P 1 21 110.91; 8.037; 17.018
90; 92.5; 90
1490.8Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020818 CIF
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C10 H4 O9 Sr2C 1 2/c 18.1694; 17.2478; 7.7689
90; 97.521; 90
1085.25Trifa, Chahrazed; Mokhtari, Samia; Bouacida, Sofiane; Boudaren, Chaouki; Boudraa, Mhamed; Merazig, Hocine
A novel three-dimensional Sr^II^ coordination polymer based on benzene-1,2,4,5-tetracarboxylate: hydrothermal synthesis, crystal structure and spectroscopic and thermal studies
Acta Crystallographica Section C, 2017, 73, 369-375
2020819 CIF
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C30 H44 Fe N10 O8P 1 21/c 18.73056; 11.7379; 17.619
90; 102.142; 90
1765.17Tanaka, Rikako; Matsushita, Nobuyuki
A charge-transfer salt composed of methyl viologen and hexacyanidoferrate(II)
Acta Crystallographica Section C, 2017, 73, 476-480
2020820 CIF
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C22 H43 Cl Fe N O P3P 1 21/c 117.0243; 10.494; 15.1374
90; 109.09; 90
2555.6Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020821 CIF
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C23 H39 Cl Fe N2 P2P 1 21/n 17.6074; 18.2229; 19.1442
90; 92.3658; 90
2651.7Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020822 CIF
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C20 H34 Cl Fe N O2 P2P 1 21/c 113.7917; 14.6349; 11.2225
90; 90.729; 90
2265Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020823 CIF
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C34 H26 Cd N2 O7P -18.073; 12.4019; 15.2718
106.744; 101.979; 96.647
1406.93Xie, Hua; Fang, Wang-Jian; Yao, Xiao-Qiang
A cadmium(II) coordination polymer with both polyrotaxane and polycatenane features constructed by a V-shaped semi-rigid ligand: synthesis and fluorescence properties
Acta Crystallographica Section C, 2017, 73, 541-545
2020824 CIF
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C14 H12 F3 I3 N2P 1 21/c 17.9818; 26.7046; 9.222
90; 115.398; 90
1775.69Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020825 CIF
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C19 H9 F3 I3 NP 1 21/c 110.5079; 12.5632; 15.1563
90; 102.49; 90
1953.47Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020826 CIF
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C18 H8 F3 I3 N2P 1 21/c 18.6445; 14.0472; 15.8147
90; 97.662; 90
1903.25Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020827 CIF
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C24 H18 Cu N2 O6P 1 21/c 111.731; 14.274; 13.211
90; 100.862; 90
2172.5Tang, Long; Zhang, Juan; Liu, Xiao-Xia; Wang, Ji-Jiang; Fu, Feng
A two-dimensional copper(II) coordination polymer based on 2,4′-oxybis(benzoate) and 4,4′-bipyridine
Acta Crystallographica Section C Structural Chemistry, 2017, 73
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C38 H35 N O2 P2P 1 21 111.7931; 10.4209; 14.0792
90; 111.081; 90
1614.46Balogh, Szabolcs; Farkas, Gergely; Holczbauer, Tamás; Bakos, József
Origin of the chemical stability of phosphine-phosphoramidites: structural study of an UPPhos-type crystal and application of UPPhos in the asymmetric hydrogenation of imines
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2020833 CIF
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C15 H9 Cr F O3P 1 21/c 17.0166; 27.4725; 7.1101
90; 113.738; 90
1254.61Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020834 CIF
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C15 H9 Cr F O3P 1 21/c 17.0616; 28.3503; 7.0571
90; 114.324; 90
1287.41Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
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2020835 CIF
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C12 H9 FF d d 212.9824; 23.0588; 5.7527
90; 90; 90
1722.1Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020836 CIF
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C12 H9 FP b c n5.6462; 20.739; 7.292
90; 90; 90
853.9Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020837 CIF
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C32 H36 Co N8 O8P 1 2/n 113.264; 9.0189; 14.709
90; 107.04; 90
1682.3Huang, Qiu-Ying; Zhao, Yang; Meng, Xiang-Ru
Syntheses, structures and characterization of isomorphous Co^II^and Ni^II^ coordination polymers based on 2-[(1<i>H</i>-imidazol-1-yl)methyl]-6-methyl-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate
Acta Crystallographica Section C, 2017, 73, 645-651
2020838 CIF
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C32 H36 N8 Ni O8P 1 2/n 113.192; 9.018; 14.67
90; 106.84; 90
1670.4Huang, Qiu-Ying; Zhao, Yang; Meng, Xiang-Ru
Syntheses, structures and characterization of isomorphous Co^II^and Ni^II^ coordination polymers based on 2-[(1<i>H</i>-imidazol-1-yl)methyl]-6-methyl-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate
Acta Crystallographica Section C, 2017, 73, 645-651
2020840 CIF
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Paper
C22 H28 O7P 1 21/c 14.9801; 17.4771; 23.1
90; 94.124; 90
2005.37Wiedemann, Dennis; Kohl, Julia
Invariom-model refinement and Hirshfeld surface analysis of well-ordered solvent-free dibenzo-21-crown-7
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020841 CIF
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C22 H28 O7P 1 21/c 14.9801; 17.4771; 23.1
90; 94.124; 90
2005.37Wiedemann, Dennis; Kohl, Julia
Invariom-model refinement and Hirshfeld surface analysis of well-ordered solvent-free dibenzo-21-crown-7
Acta Crystallographica Section C Structural Chemistry, 2017, 73
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C6 F3 I3P 1 21/c 19.3455; 13.1854; 9.2185
90; 118.466; 90
998.61Raffo, Pablo A.; Suárez, Sebastián; Fantoni, Adolfo C.; Baggio, Ricardo; Cukiernik, Fabio D.
Polymorphism of a widely used building block for halogen-bonded assemblies: 1,3,5-trifluoro-2,4,6-triiodobenzene
Acta Crystallographica Section C, 2017, 73
2020843 CIF
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C24 H28 N6 O4P c c n9.1077; 13.5893; 19.476
90; 90; 90
2410.5Martin, Kenneth L.; Breton, Gary W.
Computational, ^1^H NMR, and X-ray structural studies on 1-arylurazole tetrazane dimers
Acta Crystallographica Section C, 2017, 73
2020844 CIF
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C12 H11 Cl N3 O PP 3 c 115.8635; 15.8635; 8.9754
90; 90; 120
1956.06Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Ghorbanian, Nazila; Andreev, Pavel V.
A novel tubular hydrogen-bond pattern in a new diazaphosphole oxide: a combination of X-ray crystallography and theoretical study of hydrogen bonds
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C28 H20 N18 ZnP -18.4211; 9.5379; 9.7491
83.531; 66.048; 85.922
710.78Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020846 CIF
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C28 H20 Cd N18P -18.7209; 8.7949; 10.349
91.966; 94.945; 112.682
727.67Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020847 CIF
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C32 H20 Cd N18P -19.271; 9.571; 10.156
87.833; 68.383; 88.803
837.2Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020848 CIF
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C78 H91 Fe K N10 O8P 1 21/c 113.0866; 21.934; 24.898
90; 91.214; 90
7145.2Wu, Qi; Yao, Zhen; Li, Jianfeng
Synthesis and characterization of (cryptand-222)potassium (2-methylimidazolato)(<i>meso</i>-tetraphenylporphinato)ferrate(II)‒2-methylimidazole‒tetrahydrofuran (1/1/2)
Acta Crystallographica Section C, 2017, 73
2020849 CIF
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C20 H18 Cl2 N4 PtP 1 21/c 110.6134; 15.7166; 11.8754
90; 100.376; 90
1948.5DeStefano, Matthew R.; Geiger, David K.
A luminescent bis(pyridyl)-substituted benzimidazole platinum(II) complex exhibiting an intermolecular anagostic interaction
Acta Crystallographica Section C, 2017, 73
2020850 CIF
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C28 H30 Cl2 Cu N6 O13C 1 2/c 148.675; 8.375; 16.3155
90; 100.716; 90
6535.1Bhat, Satish S.; Revankar, Vidyanand K.; Shivalingegowda, Naveen; Lokanath, N. K.
A fluorophore-labelled copper complex: crystal structure, hybrid cyclic water‒perchlorate cluster and biological properties
Acta Crystallographica Section C, 2017, 73
2020851 CIF
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C50 H34 Cl2 N4 O14 Zn2P 1 21/n 110.6003; 14.0573; 15.8141
90; 104.016; 90
2286.33Sorenson, Shayne; Popova, Marina; Arif, Atta M.; Berreau, Lisa M.
A bipyridine-ligated zinc(II) complex with bridging flavonolate ligation: synthesis, characterization, and visible-light-induced CO release reactivity
Acta Crystallographica Section C, 2017, 73
2020852 CIF
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C20 H24 Br4 Cd Hg N2 O5P 1 21/c 17.3985; 16.498; 22.9089
90; 98.3739; 90
2766.5Truong, Khai-Nghi; Merkens, Carina; Englert, Ulli
3-(Pyridin-4-yl)acetylacetone: Cd^II^ and Hg^II^ compete for nitrogen coordination
Acta Crystallographica Section C, 2017, 73
2020853 CIF
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C21 H25 Cl O5 SP 21 21 215.3945; 9.1577; 43.475
90; 90; 90
2147.7Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
Acta Crystallographica Section C, 2017, 73
2020854 CIF
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C21 H27 Cl O6 SP 21 21 214.4659; 9.8994; 48.073
90; 90; 90
2125.3Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
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2020855 CIF
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C25 H28 Fe N4 O5P 1 21/n 110.3583; 13.1393; 17.7722
90; 92.291; 90
2416.88Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1)
Acta Crystallographica Section C, 2017, 73
2020856 CIF
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C17 H18 Cl Fe N3 O2I 1 2/a 120.8783; 7.4013; 23.2605
90; 108.146; 90
3415.6Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1)
Acta Crystallographica Section C, 2017, 73
2020857 CIF
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Paper
C13 H11 Cd N3 O7C 1 2/c 116.56; 13.383; 13.302
90; 111.47; 90
2743.5Zhou, Qian-Kun; Li, Ni-Ya
A three-dimensional cadmium coordination polymer based on 1,4-bis(1,2,4-triazol-1-yl)but-2-ene and benzene-1,3,5-tricarboxylic acid
Acta Crystallographica Section C, 2017, 73
2020858 CIF
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C11 H12 N2 O4P b c a6.9132; 8.9917; 36.898
90; 90; 90
2293.6Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Four cocrystals of thymine with phenolic coformers: influence of the coformer on hydrogen bonding
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2020859 CIF
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C16 H18 N4 O6P b c n6.9499; 9.0237; 26.828
90; 90; 90
1682.5Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Four cocrystals of thymine with phenolic coformers: influence of the coformer on hydrogen bonding
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2020860 CIF
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C16 H18 N4 O6P 1 21/c 114.204; 6.9634; 8.4505
90; 97.639; 90
828.4Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Four cocrystals of thymine with phenolic coformers: influence of the coformer on hydrogen bonding
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 602
2020861 CIF
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C17 H18 N2 O8P -16.9652; 10.2125; 12.951
97.218; 99.189; 108.549
846.7Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Four cocrystals of thymine with phenolic coformers: influence of the coformer on hydrogen bonding
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C24 H12 Cl2 Cu N8 S2C 1 2/c 18.181; 12.168; 22.99
90; 92.197; 90
2286.9Bhat, Satish S.; Revankar, Vidyanand K.; Kumbar, Vijay; Bhat, Kishore; Kawade, Vitthal A.
Synthesis, crystal structure and biological properties of a <i>cis</i>-dichloridobis(diimine)copper(II) complex
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Paper
C36 H75 Cl2 Fe7 N6 O26P a -322.0884; 22.0884; 22.0884
90; 90; 90
10776.9van der Horn, Jitschaq A.; Lutz, Martin
Triethanolaminate iron perchlorate revisited: change of space group, chemical composition and oxidation states in [Fe~7~(tea)~3~(tea-H)~3~](ClO~4~)~2~ (tea-H~3~ is triethanolamine)
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2020880 CIF
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Paper
C22 H24 Mn N10 O4P -15.9328; 10.245; 10.853
105.33; 103.2; 94
613.4Lin, Xiao-Ying; Zheng, Qin-Qin; Gong, Ling-Zhu; Liu, Ya-Min; Liu, Min-Yi; Liu, Xin-Zhong
Manganese(II), lead(II) and cadmium(II) coordination complexes containing a tetrazole-based acylamide ligand: synthesis and the influence of the metal ions on the structures
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C40 H36 N20 O6 Pb2P 1 21/c 19.1343; 14.26; 16.985
90; 91.3; 90
2211.8Lin, Xiao-Ying; Zheng, Qin-Qin; Gong, Ling-Zhu; Liu, Ya-Min; Liu, Min-Yi; Liu, Xin-Zhong
Manganese(II), lead(II) and cadmium(II) coordination complexes containing a tetrazole-based acylamide ligand: synthesis and the influence of the metal ions on the structures
Acta Crystallographica Section C, 2018, 74
2020882 CIF
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C60 H48 Cd3 N30 O6C 1 2/c 120.035; 13.401; 25.119
90; 106.58; 90
6464Lin, Xiao-Ying; Zheng, Qin-Qin; Gong, Ling-Zhu; Liu, Ya-Min; Liu, Min-Yi; Liu, Xin-Zhong
Manganese(II), lead(II) and cadmium(II) coordination complexes containing a tetrazole-based acylamide ligand: synthesis and the influence of the metal ions on the structures
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2020883 CIF
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C14 H14 Ca O8C 1 2/c 116.4233; 11.5002; 7.6203
90; 91.914; 90
1438.5Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020884 CIF
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C14 H14 Ca0.96 O8 Sr0.04C 1 2/c 116.4335; 11.4974; 7.6301
90; 91.778; 90
1440.96Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020885 CIF
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C14 H14 Ca0.92 O8 Sr0.08C 1 2/c 116.4344; 11.4853; 7.6417
90; 91.785; 90
1441.7Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
Acta Crystallographica Section C, 2018, 74
2020886 CIF
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C14 H14 Ca0.83 O8 Sr0.17C 1 2/c 116.4921; 11.5345; 7.6679
90; 91.838; 90
1457.9Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020887 CIF
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C14 H14 Ca0.69 O8 Sr0.31C 1 2/c 116.5626; 11.4921; 7.7041
90; 91.588; 90
1465.8Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020888 CIF
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C14 H14 Ca0.47 O8 Sr0.53C 1 2/c 116.5994; 11.4832; 7.765
90; 91.555; 90
1479.57Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
Acta Crystallographica Section C, 2018, 74
2020889 CIF
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C14 H14 Ca0.37 O8 Sr0.63C 1 2/c 116.6319; 11.4995; 7.7729
90; 91.599; 90
1486.05Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020890 CIF
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C14 H14 Ca0.21 O8 Sr0.79C 1 2/c 116.665; 11.4816; 7.8105
90; 91.576; 90
1493.9Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
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2020891 CIF
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Paper
C14 H14 Ca0.17 O8 Sr0.83C 1 2/c 116.6693; 11.4865; 7.8446
90; 91.51; 90
1501.5Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
Acta Crystallographica Section C, 2018, 74
2020892 CIF
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Paper
C14 H14 O8 SrC 1 2/c 116.7182; 11.4644; 7.8627
90; 91.66; 90
1506.37Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
Acta Crystallographica Section C, 2018, 74
2020893 CIF
HKL
Paper
C14 H14 Ba0.27 O8 Sr0.73C 1 2/c 116.8381; 11.4349; 7.9433
90; 91.28; 90
1529.04Allan, Pamela; Arlin, Jean-Baptiste; Kennedy, Alan R.; Walls, Aiden
Mixed Ca/Sr salt forms of salicylic acid: tuning structure and aqueous solubility
Acta Crystallographica Section C, 2018, 74
2020894 CIF
HKL
Paper
C3 H14 N10 O6P c c n12.6989; 13.0236; 14.1585
90; 90; 90
2341.61Buvaylo, Elena A.; Kokozay, Vladimir N.; Strutynska, Nataliia Yu.; Vassilyeva, Olga Yu.; Skelton, Brian W.
Formaldehyde‒aminoguanidine condensation and aminoguanidine self-condensation products: syntheses, crystal structures and characterization
Acta Crystallographica Section C, 2018, 74
2020895 CIF
HKL
Paper
C2 H10 Cl4 Cu N6P n n a8.4242; 10.0515; 13.1557
90; 90; 90
1113.97Buvaylo, Elena A.; Kokozay, Vladimir N.; Strutynska, Nataliia Yu.; Vassilyeva, Olga Yu.; Skelton, Brian W.
Formaldehyde‒aminoguanidine condensation and aminoguanidine self-condensation products: syntheses, crystal structures and characterization
Acta Crystallographica Section C, 2018, 74
2020898 CIF
HKL
Paper
C5 H7 N3P b c a5.1217; 9.8397; 21.914
90; 90; 90
1104.4Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
A new polymorph of 2,6-diaminopyridine
Acta Crystallographica Section C, 2017, 73, 990-993
2020899 CIF
HKL
Paper
C6 H8 N2P 1 21/c 14.5031; 6.586; 10.572
90; 96.54; 90
311.5Seidel, Rüdiger W.; Goddard, Richard; Nöthling, Nils; Lehmann, Christian W.
Adiponitrile at 100K
Acta Crystallographica Section C, 2017, 73, 937-940
2020900 CIF
HKL
Paper
C13 H13 N3 O SP -18.4341; 8.6991; 10.1083
91.249; 113.506; 110.292
626.74Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020901 CIF
HKL
Paper
C26 H24 Cu N8 O9 S2P b c n18.1534; 7.1814; 21.8523
90; 90; 90
2848.82Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020902 CIF
HKL
Paper
C26 H26 Au Cl3 N6 O3 S2P -110.0052; 12.594; 12.9412
111.867; 97.271; 99.755
1459.04Schroeder, Zachary W.; Hiscock, L. K.; Dawe, Louise Nicole
Copper(II)- and gold(III)-mediated cyclization of a thiourea to a substituted 2-aminobenzothiazole
Acta Crystallographica Section C, 2017, 73, 905-910
2020903 CIF
HKL
Paper
C10 H12 Cl3 K O2 PtP 1 21/c 112.0312; 16.1528; 8.1007
90; 107.295; 90
1503.09Nguyen Thi Thanh, Chi; Truong Thi Cam, Mai; Pham Van, Thong; Nguyen, Long; Nguyen Ha, My; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity of platinum(II) complexes containing eugenol and a quinolin-8-ol-derived chelator
Acta Crystallographica Section C, 2017, 73, 1030-1037
2020904 CIF
HKL
Paper
C19 H16 Cl3 N O3 PtP -18.1313; 11.296; 11.4294
88.793; 76.567; 70.219
958.93Nguyen Thi Thanh, Chi; Truong Thi Cam, Mai; Pham Van, Thong; Nguyen, Long; Nguyen Ha, My; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity of platinum(II) complexes containing eugenol and a quinolin-8-ol-derived chelator
Acta Crystallographica Section C, 2017, 73, 1030-1037
2020905 CIF
HKL
Paper
C6 H28 N12 Ni2 O8P -17.1226; 9.0134; 9.1203
103.16; 107.48; 106.69
502.4Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020906 CIF
HKL
Paper
C3 H11 Cu N5 O4P -17.2183; 7.4079; 9.887
72.45; 68.82; 62.74
432.3Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020907 CIF
HKL
Paper
C3 H29 Co2 N11 O11P 1 21/n 17.0765; 12.676; 20.591
90; 98.7; 90
1825.8Liu, Feng-Yi; Zhou, Dong-Mei; Zhao, Xiao-Lan; Kou, Jun-Feng
Complexes of nickel(II) and copper(II) with 1,2,4-triazole-3-carboxylic acid and of cobalt(III) with 3-amino-1,2,4-triazole-5-carboxylic acid
Acta Crystallographica Section C, 2017, 73, 1010-1016
2020908 CIF
HKL
Paper
C7 H8 B F3 N2 O3P 1 21/c 111.5305; 8.2823; 11.502
90; 118.304; 90
967.11Kopczyńska, Karolina; Marek, Paulina H.; Banaś, Bartłomiej; Madura, Izabela D.
Synthon preference in the cocrystal of 3,4,5-trifluorophenylboronic acid with urea
Acta Crystallographica Section C, 2017, 73, 889-895
2020909 CIF
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C3 B Li0.96P -6 m 22.5408; 2.5408; 7.5989
90; 90; 120
42.484Milashius, Viktoria; Pavlyuk, Volodymyr; Kluziak, Karolina; Dmytriv, Grygoriy; Ehrenberg, Helmut
LiBC~3~: a new borocarbide based on graphene and heterographene networks
Acta Crystallographica Section C, 2017, 73, 984-989
2020910 CIF
Paper
C24 H17 Cl2 F3 N3 O6 Re S2P -18.596; 11.217; 15.161
92.88; 104.12; 91.19
1415.06Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020911 CIF
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Paper
C27 H17 F3 N3 O6.28 Re S2P 1 21/n 112.814; 12.088; 18.248
90; 96.56; 90
2808Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020912 CIF
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Paper
C23 H15 F3 N3 O6 Re SP 1 21/n 112.398; 12.878; 15.393
90; 91.83; 90
2456.4Pinto, Miguel; Chakraborty, Indranil; Martinez-Gonzalez, Jorge; Mascharak, Pradip
Synthesis and structures of photoactive rhenium carbonyl complexes derived from 2-(pyridin-2-yl)-1,3-benzothiazole, 2-(quinolin-2-yl)-1,3-benzothiazole and 1,10-phenanthroline
Acta Crystallographica Section C, 2017, 73, 923-929
2020913 CIF
HKL
Paper
C25 H17 Cu F6 N O5P -110.5928; 10.7082; 12.4943
69.019; 71.705; 88.11
1251.32Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020914 CIF
HKL
Paper
C30 H22 Cu F6 N2 O6P 1 21/c 110.0085; 14.154; 11.2503
90; 110.022; 90
1497.4Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020915 CIF
HKL
Paper
C30 H22 Cu F6 N2 O8P -17.595; 9.6764; 10.7507
108.71; 101.727; 93.65
725.61Perdih, Franc
Copper(II) bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionate) complexes with pyridin-2-one, 3-hydroxypyridine and 3-hydroxypyridin-2-one ligands: molecular structures and hydrogen-bonded networks
Acta Crystallographica Section C, 2017, 73, 960-967
2020916 CIF
HKL
Paper
C19 H22 Cd N10P -17.3585; 8.796; 17.619
79.56; 84.69; 78.96
1098.8Lu, Yang; Liao, Wei-Qiang; Hua, Xiu-Ni
A new two-dimensional polymeric cadmium(II) complex containing dicyanamide bridging ligands
Acta Crystallographica Section C, 2017, 73, 885-888
2020917 CIF
HKL
Paper
C12 H15 N O2P b c a9.207; 8.21; 28.27
90; 90; 90
2136.91Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020918 CIF
HKL
Paper
C13 H17 N O2P b c a10.627; 9.249; 24.623
90; 90; 90
2420.17Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020919 CIF
HKL
Paper
C14 H17 N O2P 1 21/c 114.294; 11.448; 16.112
90; 110.158; 90
2475Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Crystallographic studies of cinnamamide derivatives as a means of searching for anticonvulsant activity
Acta Crystallographica Section C, 2017, 73, 953-959
2020920 CIF
HKL
Paper
C13 H13 Cl2 N3 O3P -19.3874; 10.5102; 15.4295
71.167; 83.335; 87.73
1431.09Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020921 CIF
HKL
Paper
C13 H13 Cl2 N3 O3P 1 21/c 124.7483; 6.9525; 18.1423
90; 111.5; 90
2904.4Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020922 CIF
HKL
Paper
C11 H13 N3 O4 SP 1 21/n 16.7335; 7.6307; 25.0638
90; 93.928; 90
1284.79Rajam, Ammaiyappan; Muthiah, P. Thomas; Butcher, Ray J.; Jasinski, Jerry P.; Glidewell, Christopher
Cation tautomerism, twinning and disorder in the triclinic and monoclinic forms of 4-amino-5-chloro-2,6-dimethylpyrimidinium 5-chloro-2-hydroxybenzoate and a new disordered refinement of 2-amino-4,6-dimethoxypyrimidin-1-ium thiophene-2-carboxylate
Acta Crystallographica Section C, 2017, 73, 862-868
2020923 CIF
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Paper
Cs3 Li O16 W4 Zn2I -4 3 d12.2643; 12.2643; 12.2643
90; 90; 90
1844.71Solodovnikov, Sergey F.; Solodovnikova, Zoya A.; Zolotova, Evgeniya S.; Kadyrova, Yulia M.; Savina, Aleksandra A.; Stefanovich, Sergey Yu.; Khaikina, Elena G.
Cs~3~LiZn~2~(WO~4~)~4~ and Rb~3~Li~2~Ga(MoO~4~)~4~: different filled derivatives of the cation-deficient Cs~6~Zn~5~(MoO~4~)~8~ structure
Acta Crystallographica Section C, 2017, 73, 946-952
2020924 CIF
HKL
Paper
Ga Li2 Mo4 O16 Rb3I -4 2 d11.8635; 11.8635; 11.8932
90; 90; 90
1673.88Solodovnikov, Sergey F.; Solodovnikova, Zoya A.; Zolotova, Evgeniya S.; Kadyrova, Yulia M.; Savina, Aleksandra A.; Stefanovich, Sergey Yu.; Khaikina, Elena G.
Cs~3~LiZn~2~(WO~4~)~4~ and Rb~3~Li~2~Ga(MoO~4~)~4~: different filled derivatives of the cation-deficient Cs~6~Zn~5~(MoO~4~)~8~ structure
Acta Crystallographica Section C, 2017, 73, 946-952
2020925 CIF
HKL
Paper
C69.27 H64.81 O16.14P -112.519; 12.594; 19.975
80.12; 89.69; 68.02
2871.2Vinokur, Anastasiya I.; White, Paul B.; Fotsing, Maurice Tagatsing; Arderne, Charmaine; Ndinteh, Derek Tantoh; Vestling, Martha M.; Guzei, Ilia A.
Deciphering composition and connectivity of a natural product with the assistance of MS and 2D NMR
Acta Crystallographica Section C, 2017, 73, 994-1002
2020926 CIF
HKL
Paper
C18 H15 Br O5P 1 21/n 111.96; 9.025; 14.981
90; 96.768; 90
1605.8Li, Ning; Yao, Binrong; Wang, Chunhua; Meng, Qingguo; Hou, Guige
Synthesis, crystal structure and activity evaluation of novel 3,4-dihydro-1-benzoxepin-5(2<i>H</i>)-one derivatives as protein‒tyrosine kinase (PTK) inhibitors
Acta Crystallographica Section C, 2017, 73, 1003-1009
2020927 CIF
HKL
Paper
C8 H10 F Na O5P 1 21/n 15.4784; 5.9139; 30.379
90; 92.54; 90
983.27Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020928 CIF
HKL
Paper
C8 H6 F K O3P 1 21/c 118.3542; 6.9466; 6.5969
90; 92.995; 90
839.95Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020929 CIF
HKL
Paper
C8 H6 F O3 RbP 1 21/c 118.0011; 7.1625; 6.8548
90; 91.995; 90
883.27Smith, Graham
Two-dimensional coordination polymeric structures in the sodium, potassium and rubidium complex salts with (4-fluorophenoxy)acetic acid
Acta Crystallographica Section C, 2017, 73, 979-983
2020930 CIF
HKL
Paper
C21 H15 Ag N2 O6P 1 21/n 18.4981; 17.669; 12.658
90; 100.95; 90
1866Chen, Jing-Min; Zhou, Qian-Kun; Hou, Yi-Xuan; Liu, Dong
Construction and photocatalytic properties of two metal-mediated coordination polymers based on benzene-1,3,5-tricarboxylic acid and <i>trans</i>-1-(pyridin-3-yl)-2-(pyridin-4-yl)ethene
Acta Crystallographica Section C, 2017, 73, 1017-1023
2020931 CIF
HKL
Paper
C21 H16 Cd N2 O7P -19.4176; 9.861; 12.269
91.11; 103.34; 117.23
975.4Chen, Jing-Min; Zhou, Qian-Kun; Hou, Yi-Xuan; Liu, Dong
Construction and photocatalytic properties of two metal-mediated coordination polymers based on benzene-1,3,5-tricarboxylic acid and <i>trans</i>-1-(pyridin-3-yl)-2-(pyridin-4-yl)ethene
Acta Crystallographica Section C, 2017, 73, 1017-1023
2020932 CIF
HKL
Paper
C19 H35 N P2P 1 2/c 116.2905; 6.751; 18.9112
90; 98.2024; 90
2058.52Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020933 CIF
HKL
Paper
C19 H35 Cl2 Fe N P2P -18.2907; 10.7222; 13.6434
87.0826; 80.8448; 75.7315
1160.35Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020934 CIF
HKL
Paper
C19 H35 Cl2 Co N P2P -18.2603; 10.722; 13.6314
86.8728; 80.5491; 75.6607
1153.68Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020935 CIF
HKL
Paper
C22 H35 Br Mn N O3 P2P 1 21/n 110.6732; 15.6935; 15.1651
90; 96.0732; 90
2525.9Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
Acta Crystallographica Section C, 2017, 73, 917-922
2020936 CIF
HKL
Paper
C20 H22 Cd N2 O5P -18.7119; 10.318; 10.961
83.47; 82.91; 84.71
968.3Hou, Yi-Xuan; Liu, Dong
A three-dimensional supramolecular framework based on the interlinkage of an interpenetrating diamondoid coordination network
Acta Crystallographica Section C, 2017, 73, 869-873
2020937 CIF
HKL
Paper
C27 H28 N6 O6 PtP -110.264; 12.066; 13.382
98.7061; 110.591; 113.591
1336.8Kiwada, Tatsuto; Takayama, Hiroshi; Hirasaki, Aika; Ogawa, Kazuma; Odani, Akira
Asymmetric structure of <i>cis</i>-[<i>N</i>-(9-anthracenylmethyl)-1,2-ethanediamine]dipyridineplatinum(II) dinitrate
Acta Crystallographica Section C, 2017, 73, 975-978
2020938 CIF
HKL
Paper
C11 H7 Co Cu4 N26 OP n m a12.3459; 15.9301; 14.7454
90; 90; 90
2900Qin, Ying-Lian; Qin, Jian-Fang; Sun, Hong
A novel tetrazolate- and cyanide-bridged three-dimensional heterometallic coordination polymer: crystal structure, thermal stability and magnetic properties
Acta Crystallographica Section C, 2017, 73, 968-974
2020939 CIF
Paper
C25 H29 Cu F6 N3 O8 S2P -18.8133; 11.8; 15.404
96.363; 93.886; 105.518
1526.1Sivanesan, Dharmalingam; Youn, Min Hye; Park, Ki Tae; Kim, Hak Joo; Grace, Andrews Nirmala; Jeong, Soon Kwan
Mono- and dinuclear Cu^II^ complexes of the benzyldipicolylamine (BDPA) ligand: crystal structure, synthesis and characterization
Acta Crystallographica Section C, 2017, 73, 1024-1029
2020940 CIF
Paper
C42 H38 Cu2 F12 N6 O12 S4P -18.8793; 10.5542; 14.162
103.357; 94.115; 102.742
1248.9Sivanesan, Dharmalingam; Youn, Min Hye; Park, Ki Tae; Kim, Hak Joo; Grace, Andrews Nirmala; Jeong, Soon Kwan
Mono- and dinuclear Cu^II^ complexes of the benzyldipicolylamine (BDPA) ligand: crystal structure, synthesis and characterization
Acta Crystallographica Section C, 2017, 73, 1024-1029
2020941 CIF
HKL
Paper
C6 H20 N22 O2P 1 21/c 112.231; 3.919; 17.968
90; 92.949; 90
860.1Liu, Qing; Chen, Xiang; Cao, Wenli; Yang, Jin; Zhang, Wenhui; Ren, Yinghui; Ma, Haixia; Zhao, Fengqi; Hu, Rongzu
The synthesis, crystal structure and thermal properties of an energetic compound: the hydrated azanium salt of 3,6-bis[(1<i>H</i>-1,2,3,4-tetrazol-5-yl)amino]-1,2,4,5-tetrazine
Acta Crystallographica Section C, 2017, 73, 941-945
2020942 CIF
HKL
Paper
C12 H10 Cd N6 O6C 1 2/c 120.0932; 7.1128; 10.4548
90; 96.857; 90
1483.5Meng, Li; Zhu, Miao-Li; Lu, Li-Ping
Synthesis, crystal structure and characterization of a three-dimensional Cd^II^ coordination polymer constructed from 2,5-bis(1<i>H</i>-1,2,4-triazol-1-yl)terephthalate
Acta Crystallographica Section C, 2018, 74
2020943 CIF
HKL
Paper
C28 H28 N2 O2P 1 21/c 123.3641; 10.0825; 21.4524
90; 115.885; 90
4546.5Acosta Quintero, Lina M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A versatile synthesis of cyclic dipeptides using the stepwise construction of the piperazine-2,5-dione ring from simple precursors: synthetic sequence and the structure of a representative product, (3<i>RS</i>)-4-(2-allyl-3,5-dimethylphenyl)-1-benzyl-3-phenylpiperazine-2,5-dione
Acta Crystallographica Section C, 2018, 74
2020944 CIF
HKL
Paper
C22 H14 N4P 1 21/n 13.761; 13.2538; 18.8657
90; 91.226; 90
940.19Sun, Peili; Zhang, Zongyao; Luo, Hongxia; Zhang, Pu; Qin, Yujun; Guo, Zhi-Xin
Synthesis, crystal structure and photophysical properties of 1,4-bis(1,3-diazaazulen-2-yl)benzene: a new π building block
Acta Crystallographica Section C, 2018, 74
2020945 CIF
HKL
C42 H35 Ag4 N6 O9.5 S8.5P -113.771; 13.9822; 14.7181
81.074; 79.523; 73.152
2651.24Dennehy, Mariana; Amo-Ochoa, Pilar; Freire, Eleonora; Suárez, Sebastián; Halac, Emilia; Baggio, Ricardo
Structure and electrical properties of a one-dimensional polymeric silver thiosaccharinate complex with argentophilic interactions
Acta Crystallographica Section C, 2018, 74
2020946 CIFC7 H13 N O8P -14.9216; 8.5949; 12.1187
108.61; 97.243; 92.752
479.82Losev, Evgeniy; Boldyreva, Elena
The effect of amino acid backbone length on molecular packing: crystalline tartrates of glycine, β-alanine, γ-aminobutyric acid (GABA) and <small>DL</small>-α-aminobutyric acid (AABA)
Acta Crystallographica Section C, 2018, 74
2020947 CIFC8 H15 N O8P -14.9336; 10.0324; 11.3232
103.464; 94.31; 99.766
533.29Losev, Evgeniy; Boldyreva, Elena
The effect of amino acid backbone length on molecular packing: crystalline tartrates of glycine, β-alanine, γ-aminobutyric acid (GABA) and <small>DL</small>-α-aminobutyric acid (AABA)
Acta Crystallographica Section C, 2018, 74
2020948 CIF
HKL
Paper
C152 H110 Cd5 N14 O30 S10P -114.444; 17.342; 19.351
68.318; 70.484; 75.994
4206.4Ji, Ning-Ning; Shi, Zhi-Qiang; Hu, Hai-Liang
A new Cd^II^ coordination polymer with a self-penetrating architecture induced by the molecular conformation of a rigid bithiophene ligand
Acta Crystallographica Section C, 2018, 74
2020949 CIF
HKL
Paper
C20 H16 Cl N O2 SP 1 21/c 19.7868; 13.9567; 13.3764
90; 101.816; 90
1788.4Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020950 CIF
HKL
Paper
C26 H20 Cl N O2 SP 1 21/c 110.7264; 9.1208; 22.9103
90; 94.414; 90
2234.7Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020951 CIF
HKL
Paper
C20 H15 Br Cl N O2 SC 1 2/c 118.8096; 11.5021; 19.9112
90; 118.03; 90
3802.5Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020952 CIF
HKL
Paper
C20 H15 Cl I N O2 SP 1 21/n 18.1813; 11.8276; 20.1347
90; 94.388; 90
1942.6Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020953 CIF
HKL
Paper
C21 H18 Cl N O3 SP -17.4798; 11.4237; 12.0933
105.814; 101.959; 99.187
946.66Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020954 CIF
HKL
Paper
C20 H14 Cl F2 N O2 SC 1 2/c 158.0164; 7.8002; 16.1365
90; 92.105; 90
7297.5Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020955 CIF
HKL
Paper
C15 H13 N3 O4P -18.1296; 9.5899; 10.8824
66.84; 71.533; 71.35
721.1Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Synthesis and structures of six closely related <i>N</i>-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]arylamides, together with an isolated reaction intermediate: order <i>versus</i> disorder, molecular conformations and hydrogen bonding in zero, one and two dimensions
Acta Crystallographica Section C, 2018, 74
2020956 CIF
Paper
Cl H4 Li O2P 1 21/c 16.0838; 9.3592; 6.0632
90; 113.543; 90
316.5Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020957 CIF
Paper
Br H4 Li O2P -15.3001; 6.397; 6.406
63.694; 82.044; 65.567
177Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020958 CIF
Paper
H4 I Li O2P -15.454; 6.842; 6.97
61.9; 80.72; 67.02
211.1Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020959 CIF
Paper
Cl H6 Li O3C m c m7.1626; 10.351; 5.6038
90; 90; 90
415.47Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020960 CIF
Paper
Br H6 Li O3C m c m7.2785; 11.088; 5.687
90; 90; 90
459Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020961 CIF
Paper
H6 I Li O3P 63/m m c7.461; 7.461; 5.459
90; 90; 120
263.17Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020962 CIF
Paper
Cl H10 Li O5P -16.247; 9.232; 11.677
88.34; 77.53; 70.77
620.2Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020963 CIF
Paper
Br H10 Li O5P -16.353; 9.453; 11.954
89.15; 77.53; 71.69
664.4Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
Higher hydrates of lithium chloride, lithium bromide and lithium iodide
Acta Crystallographica Section C, 2018, 74
2020964 CIF
HKL
Paper
C26 H14 Fe2 O6 S2P -110.1425; 16.1771; 24.5865
106.98; 99.453; 96.998
3743.7Mebi, Charles; Gerasimchuk, Nikolay; Labrecque, Jordan
Crystal and electronic structure of a hexacarbonyldiiron cluster tethered to naphthalene-2-thiolate ligands
Acta Crystallographica Section C, 2018, 74
2020965 CIF
HKL
Paper
C27 H24 N2 O2P b c a18.4485; 11.6452; 19.5931
90; 90; 90
4209.31Han, Shu-Ying; Niu, Xue; Wang, Jia; Jin, Guo-Xia; Liu, Ai; Ma, Jian-Ping
Characterization and gas adsorption of a novel three-dimensional metal‒organic framework (MOF) generated from a new polydentate fluorene-bridged ligand
Acta Crystallographica Section C, 2018, 74
2020966 CIF
HKL
C30 H36 N2 Ni O9 SP 1 21/c 110.281; 23.5073; 12.3557
90; 95.674; 90
2971.48Han, Shu-Ying; Niu, Xue; Wang, Jia; Jin, Guo-Xia; Liu, Ai; Ma, Jian-Ping
Characterization and gas adsorption of a novel three-dimensional metal‒organic framework (MOF) generated from a new polydentate fluorene-bridged ligand
Acta Crystallographica Section C, 2018, 74
2020967 CIF
HKL
Paper
C20 H23 Cl N4 O5P -19.0137; 10.608; 11.8132
84.941; 85.798; 69.408
1052.18Faroque, Muhammad Umer; Noureen, Sajida; Ahmed, Maqsood; Tahir, Muhammad Nawaz
Electrostatic properties of the pyrimethamine‒2,4-dihydroxybenzoic acid cocrystal in methanol studied using transferred electron-density parameters
Acta Crystallographica Section C, 2018, 74, 100-107
2020968 CIF
HKL
Paper
C22 H18 F N O2 SP 1 21/c 115.9489; 7.2739; 15.9222
90; 95.813; 90
1837.6Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene
Acta Crystallographica Section C, 2018, 74, 45-53
2020969 CIF
HKL
Paper
C22 H18 Cl N O2 SP 1 21/n 111.6776; 14.2461; 12.2957
90; 109.336; 90
1930.13Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene
Acta Crystallographica Section C, 2018, 74, 45-53
2020970 CIF
HKL
Paper
C22 H17 F2 N O2 SP -17.6718; 9.8833; 13.5925
104.925; 95.476; 103.633
954.32Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene
Acta Crystallographica Section C, 2018, 74, 45-53
2020971 CIF
HKL
Paper
C23 H21 N O3 SP -18.5129; 12.923; 19.031
96.811; 102.665; 105.321
1935.1Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene
Acta Crystallographica Section C, 2018, 74, 45-53
2020972 CIF
HKL
Paper
C15 H15 N O SP n a 219.208; 14.0485; 10.3826
90; 90; 90
1343.08Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher
Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene
Acta Crystallographica Section C, 2018, 74, 45-53
2020973 CIF
HKL
C13 H18 N10 O SP -17.7255; 9.1381; 12.4594
92.241; 104.034; 97.248
844.3Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020974 CIF
HKL
C21 H31 N13 O3 S2C 1 c 110.0743; 14.383; 18.647
90; 100.427; 90
2657.3Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020975 CIF
HKL
C15.5 H18.5 N7.5 O1.5 SP 1 21/n 111.1237; 19.5259; 16.7313
90; 100.9; 90
3568.5Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020976 CIF
HKL
C21 H31 N13 O5 S2C 1 2/c 122.573; 9.1593; 13.9211
90; 98.701; 90
2845.1Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020977 CIF
HKL
C22 H33 N13 O5 S2C 1 2/c 123.53; 8.7478; 14.2006
90; 102.037; 90
2858.7Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020978 CIF
HKL
C21 H30 N18 O3 S3R -317.6827; 17.6827; 16.4925
90; 90; 120
4466Hützler, Wilhelm Maximilian; Bolte, Michael
Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine
Acta Crystallographica Section C, 2018, 74, 21-30
2020979 CIF
HKL
Paper
C28 H44 N2P 1 21/n 112.992; 12.399; 23.385
90; 92.81; 90
3763Dolinar, Brian S.; Samedov, Kerim; Maloney, Andrew G. P.; West, Robert; Khrustalev, Victor N.; Guzei, Ilia A.
A chiral diamine: practical implications of a three-stereoisomer cocrystallization
Acta Crystallographica Section C, 2018, 74, 54-61
2020980 CIF
HKL
Paper
C51 H42 Cu3 F6 I2 N3 P4P 1 21/n 118.931; 12.4391; 21.78
90; 98.012; 90
5078.8Zhu, Qiu-Meng; Song, Li; Chai, Wen-Xiang; Shen, Hang-Yan; Wei, Qin-Hua; Qin, Lai-Shun
A novel luminescent ionic trinuclear Cu~3~I~2~ cluster cuprous complex supported by a P^N ligand: synthesis, structure characterization, properties and TD‒DFT calculations
Acta Crystallographica Section C, 2018, 74, 62-68
2020981 CIFC16 H14 N2 O4 SP -16.9783; 9.7631; 11.8912
78.365; 74.458; 81.063
760.07Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin
Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives
Acta Crystallographica Section C, 2018, 74, 31-36
2020982 CIFC16 H13 N3 O6 SP -17.1547; 10.4322; 11.8228
100.106; 104.043; 102.278
812.14Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin
Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives
Acta Crystallographica Section C, 2018, 74, 31-36
2020983 CIFC17 H16 N2 O5 SP 1 21/n 110.9408; 7.2555; 21.1923
90; 99.838; 90
1657.5Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin
Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives
Acta Crystallographica Section C, 2018, 74, 31-36
2020984 CIFC18 H20 N2 O5 SP 1 21/c 115.356; 7.4014; 25.061
90; 141.36; 90
1778.6Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin
Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives
Acta Crystallographica Section C, 2018, 74, 31-36
2020985 CIF
HKL
Paper
C30 H38 N10 O5 ZnP -18.7481; 11.9399; 16.4168
84.921; 88.623; 71.161
1616.51Liu, Yaru; Liu, Lan; Zhang, Xiao; Liang, Guorui; Gong, Xuebing
Two zinc(II) coordination complexes based on an asymmetric multidentate ligand: syntheses, structures, selective fluorescence sensing of iron(III) ions and thermal analyses
Acta Crystallographica Section C, 2018, 74, 13-20
2020986 CIF
HKL
C26 H30 N16 ZnP -17.087; 13.7109; 15.2483
84.36; 83.99; 82.531
1455.62Liu, Yaru; Liu, Lan; Zhang, Xiao; Liang, Guorui; Gong, Xuebing
Two zinc(II) coordination complexes based on an asymmetric multidentate ligand: syntheses, structures, selective fluorescence sensing of iron(III) ions and thermal analyses
Acta Crystallographica Section C, 2018, 74, 13-20
2020987 CIF
HKL
Paper
C6 H11 N O5 SP 1 21/n 111.3338; 5.765; 13.9048
90; 110.371; 90
851.71Langenstück, Stefanie; Zhao, Chenchen; Englert, Ulli
The ephemeral dihydrate of sulfanilic acid
Acta Crystallographica Section C, 2018, 74, 7-12
2020988 CIF
HKL
Paper
C30 H38 N6 O10 S4P -18.5763; 9.7305; 11.4194
111.379; 108.656; 93.04
825.08Som, Bozumeh; Shue, Jessica R.; Smith, Mark D.; Shimizu, Linda S.
Temperature-induced pseudopolymorphism of molecular salts from a pyridyl bis-urea macrocycle and naphthalene-1,5-disulfonic acid
Acta Crystallographica Section C, 2018, 74, 75-81
2020989 CIF
HKL
Paper
C28 H32 N6 O9 S3P 1 21/n 18.9076; 25.5878; 13.6411
90; 105.644; 90
2994Som, Bozumeh; Shue, Jessica R.; Smith, Mark D.; Shimizu, Linda S.
Temperature-induced pseudopolymorphism of molecular salts from a pyridyl bis-urea macrocycle and naphthalene-1,5-disulfonic acid
Acta Crystallographica Section C, 2018, 74, 75-81
2020990 CIF
HKL
Paper
C16 H16 Cl N3P b c m8.8317; 24.261; 6.9706
90; 90; 90
1493.6Macías, Mario A.; Castillo, Juan-Carlos; Portilla, Jaime
A series of (<i>E</i>)-5-(arylideneamino)-1-<i>tert</i>-butyl-1<i>H</i>-pyrrole-3-carbonitriles and their reduction products to secondary amines: syntheses and X-ray structural studies
Acta Crystallographica Section C, 2018, 74, 82-93
2020991 CIF
HKL
Paper
C16 H15 Cl2 N3P 1 21/c 16.5428; 7.9586; 30.415
90; 92.987; 90
1581.6Macías, Mario A.; Castillo, Juan-Carlos; Portilla, Jaime
A series of (<i>E</i>)-5-(arylideneamino)-1-<i>tert</i>-butyl-1<i>H</i>-pyrrole-3-carbonitriles and their reduction products to secondary amines: syntheses and X-ray structural studies
Acta Crystallographica Section C, 2018, 74, 82-93
2020992 CIF
HKL
Paper
C15 H16 N4P -18.1494; 9.0629; 9.4859
92.465; 97.113; 97.136
688.61Macías, Mario A.; Castillo, Juan-Carlos; Portilla, Jaime
A series of (<i>E</i>)-5-(arylideneamino)-1-<i>tert</i>-butyl-1<i>H</i>-pyrrole-3-carbonitriles and their reduction products to secondary amines: syntheses and X-ray structural studies
Acta Crystallographica Section C, 2018, 74, 82-93
2020993 CIF
HKL
Paper
C16 H18 Cl N3P 1 21/c 18.2422; 9.2361; 20.623
90; 98.521; 90
1552.6Macías, Mario A.; Castillo, Juan-Carlos; Portilla, Jaime
A series of (<i>E</i>)-5-(arylideneamino)-1-<i>tert</i>-butyl-1<i>H</i>-pyrrole-3-carbonitriles and their reduction products to secondary amines: syntheses and X-ray structural studies
Acta Crystallographica Section C, 2018, 74, 82-93
2020994 CIF
HKL
Paper
C16 H17 Cl2 N3P -18.97; 9.3244; 10.4645
105.057; 103.589; 95.078
811Macías, Mario A.; Castillo, Juan-Carlos; Portilla, Jaime
A series of (<i>E</i>)-5-(arylideneamino)-1-<i>tert</i>-butyl-1<i>H</i>-pyrrole-3-carbonitriles and their reduction products to secondary amines: syntheses and X-ray structural studies
Acta Crystallographica Section C, 2018, 74, 82-93
2020995 CIF
HKL
Paper
C5 H6 Cl N5 OP 1 21/c 114.0359; 13.693; 7.7026
90; 92.754; 90
1478.68Budniak, Urszula Anna; Dominiak, Paulina Maria
Molecular tapes in the structure of isoguaninium chloride
Acta Crystallographica Section C, 2018, 74, 108-112
2020996 CIF
HKL
Paper
C56 H36 Cd Cl14 N8 O16P 1 21 113.8485; 15.0536; 16.6819
90; 109.395; 90
3280.3Liu, Jian-Jun; Dong, Ying; Chen, Li-Zhen; Wang, Ling; Xia, Shu-Biao; Huang, Chang-Cang
A two-dimensional Cd^II^ coordination polymer based on naphthalenediimide: synthesis, crystal structure and photochromic properties
Acta Crystallographica Section C, 2018, 74, 94-99
2020998 CIF
HKL
Paper
C30 H22 Ca N2 O4P b c n27.0933; 11.2988; 7.8989
90; 90; 90
2418.03Bendjellal, Nassima; Trifa, Chahrazed; Bouacida, Sofiane; Boudaren, Chaouki; Boudraa, Mhamed; Merazig, Hocine
Two novel alkaline earth coordination polymers constructed from cinnamic acid and 1,10-phenanthroline: synthesis and structural and thermal properties
Acta Crystallographica Section C, 2018, 74
2020999 CIF
HKL
Paper
C30 H22 Ba N2 O4R -3 :H36.4542; 36.4542; 10.3535
90; 90; 120
11915.5Bendjellal, Nassima; Trifa, Chahrazed; Bouacida, Sofiane; Boudaren, Chaouki; Boudraa, Mhamed; Merazig, Hocine
Two novel alkaline earth coordination polymers constructed from cinnamic acid and 1,10-phenanthroline: synthesis and structural and thermal properties
Acta Crystallographica Section C, 2018, 74
2021000 CIF
HKL
Paper
F12 Hf2 Sr2P 1 21/c 15.9762; 5.9949; 14.426
90; 99.36; 90
509.96Laval, Jean-Paul; Mayet, Richard
High-temperature monoclinic α-SrHfF~6~, and isostructural α-SrZrF~6~: associating Hf~2~F~12~ bipolyhedra and SrF~8~ snub disphenoids
Acta Crystallographica Section C, 2018, 74
2021002 CIF
HKL
Paper
C13 H15 Cu N3 O8P 1 21/c 110.8492; 14.2931; 9.8604
90; 109.543; 90
1440.95Klongdee, Fatima; Boonmak, Jaursup; Youngme, Sujittra
Effect of pH on the charge-assisted hydrogen-bonded assembly of the anionic [Cu(oxalate)~2~]^2{-^} building unit and <i>N</i>,<i>N</i>'-ditopic cations
Acta Crystallographica Section C, 2018, 74
2021003 CIF
HKL
Paper
C16 H14 Cu N2 O8P -13.8486; 10.238; 10.608
109.382; 95.641; 97.93
385.85Klongdee, Fatima; Boonmak, Jaursup; Youngme, Sujittra
Effect of pH on the charge-assisted hydrogen-bonded assembly of the anionic [Cu(oxalate)~2~]^2{-^} building unit and <i>N</i>,<i>N</i>'-ditopic cations
Acta Crystallographica Section C, 2018, 74
2021004 CIF
HKL
Paper
Bi8.27 Ca11 In1.73I 4/m m m12.3534; 12.3534; 17.433
90; 90; 90
2660.4Ovchinnikov, Alexander; Bobev, Svilen
On the effect of Ga and In substitutions in the Ca~11~Bi~10~ and Yb~11~Bi~10~ bismuthides crystallizing in the tetragonal Ho~11~Ge~10~ structure type
Acta Crystallographica Section C, 2018, 74
2021005 CIF
HKL
C18 H26.48 N2 O9.24C 2 2 2116.3993; 12.5755; 21.2196
90; 90; 90
4376.1Veselovsky, Vladimir V.; Lozanova, Antonina V.; Isaeva, Vera I.; Lobova, Anna A.; Fitch, Andrew N.; Chernyshev, Vladimir V.
Optically active derivatives of terephthalic acid: four crystal structures from two powder patterns
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021006 CIF
HKL
C18 H26.16 N2 O9.08P 2 2 2116.4332; 12.3817; 21.3581
90; 90; 90
4345.8Veselovsky, Vladimir V.; Lozanova, Antonina V.; Isaeva, Vera I.; Lobova, Anna A.; Fitch, Andrew N.; Chernyshev, Vladimir V.
Optically active derivatives of terephthalic acid: four crystal structures from two powder patterns
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021007 CIF
HKL
C13 H14 N2 O5C 2 2 217.622; 18.818; 17.4277
90; 90; 90
2499.7Veselovsky, Vladimir V.; Lozanova, Antonina V.; Isaeva, Vera I.; Lobova, Anna A.; Fitch, Andrew N.; Chernyshev, Vladimir V.
Optically active derivatives of terephthalic acid: four crystal structures from two powder patterns
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021008 CIF
HKL
C13 H14 N2 O5P 21 21 2117.4407; 9.7795; 7.0567
90; 90; 90
1203.6Veselovsky, Vladimir V.; Lozanova, Antonina V.; Isaeva, Vera I.; Lobova, Anna A.; Fitch, Andrew N.; Chernyshev, Vladimir V.
Optically active derivatives of terephthalic acid: four crystal structures from two powder patterns
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021009 CIF
HKL
Paper
C12 H16 O5P -17.8601; 8.2489; 10.7883
81.538; 72.352; 61.93
588.15Nestler, Robert; Schwarzer, Anke; Gruber, Tobias
Different supramolecular interactions mediated by Br atoms in the crystal structures of three anisole derivatives
Acta Crystallographica Section C, 2018, 74
2021010 CIF
HKL
Paper
C9 H11 Br O3P n a 2113.1596; 16.2514; 4.4735
90; 90; 90
956.71Nestler, Robert; Schwarzer, Anke; Gruber, Tobias
Different supramolecular interactions mediated by Br atoms in the crystal structures of three anisole derivatives
Acta Crystallographica Section C, 2018, 74
2021011 CIF
HKL
Paper
C9 H9 Br3 OC 1 2/c 133.315; 4.3913; 15.9655
90; 110.142; 90
2192.8Nestler, Robert; Schwarzer, Anke; Gruber, Tobias
Different supramolecular interactions mediated by Br atoms in the crystal structures of three anisole derivatives
Acta Crystallographica Section C, 2018, 74
2021012 CIF
HKL
Paper
Au1.23 In0.93 Pd1.84P m -3 m4.034; 4.034; 4.034
90; 90; 90
65.646Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021013 CIF
HKL
Paper
Au1.23 In0.93 Pd1.84P m -3 m4.034; 4.034; 4.034
90; 90; 90
65.646Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021014 CIF
HKL
Paper
Au1.49 In0.89 Pd1.62P m -3 m4.0408; 4.0408; 4.0408
90; 90; 90
65.98Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021015 CIF
HKL
Paper
Au1.49 In0.89 Pd1.62P m -3 m4.0408; 4.0408; 4.0408
90; 90; 90
65.98Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021016 CIF
HKL
Paper
Au1.77 In0.86 Pd1.37P m -3 m4.0538; 4.0538; 4.0538
90; 90; 90
66.62Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021017 CIF
HKL
Paper
Au1.77 In0.86 Pd1.37P m -3 m4.0538; 4.0538; 4.0538
90; 90; 90
66.62Ptashkina, Evgeniya A.; Kabanova, Elizaveta G.; Tursina, Anna I.; Yatsenko, Alexandr V.; Kuznetsov, Victor N.
Synthesis and crystal structure of a new Cu~3~Au-type ternary phase in the Au‒In‒Pd system: distribution of atoms over crystallographic positions
Acta Crystallographica Section C, 2018, 74
2021018 CIF
HKL
Paper
C64 H77 N3 O14P 21 21 2113.0034; 14.0829; 31.479
90; 90; 90
5764.6Gonçalves, Karolina de Oliveira; Ribeiro, Leandro; de Oliveira, Cecilia Maria Alves; Carvalho, Jesiel Freitas; Martins, Felipe T.
New solvates of the drug naltrexone: protonation, conformation and interplay of synthons
Acta Crystallographica Section C, 2018, 74
2021019 CIF
HKL
Paper
C44 H56 N2 O9P 21 21 2112.5992; 13.1093; 26.6586
90; 90; 90
4403.11Gonçalves, Karolina de Oliveira; Ribeiro, Leandro; de Oliveira, Cecilia Maria Alves; Carvalho, Jesiel Freitas; Martins, Felipe T.
New solvates of the drug naltrexone: protonation, conformation and interplay of synthons
Acta Crystallographica Section C, 2018, 74
2021020 CIF
HKL
C17 H17 Cl O6P 21 21 2111.7625; 12.00313; 24.2755
90; 90; 90
3427.38Mahieu, Aurélien; Willart, Jean-François; Guerain, Mathieu; Derollez, Patrick; Danéde, Florence; Descamps, Marc
Structure determination of phase II of the antifungal drug griseofulvin by powder X-ray diffraction
Acta Crystallographica Section C, 2018, 74
2021021 CIF
HKL
Paper
C10 H11 Cl N4 O4P c c n19.5314; 12.7103; 9.8189
90; 90; 90
2437.5Swinton Darious, Robert; Jasmine, Nithianantham Jeeva; Karthikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in cytosinium 6-chloronicotinate monohydrate and 5-bromo-6-methylisocytosinium hydrogen sulfate
Acta Crystallographica Section C, 2018, 74
2021022 CIF
HKL
Paper
C5 H8 Br N3 O5 SP 1 21/c 116.1671; 4.8786; 12.0863
90; 96.026; 90
948.01Swinton Darious, Robert; Jasmine, Nithianantham Jeeva; Karthikeyan, Ammasai; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in cytosinium 6-chloronicotinate monohydrate and 5-bromo-6-methylisocytosinium hydrogen sulfate
Acta Crystallographica Section C, 2018, 74
2021023 CIF
HKL
Paper
C22 H24 N4P b c a11.202; 16.609; 19.85
90; 90; 90
3693.2Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise, efficient and versatile synthesis of amino-substituted benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepines: synthesis and spectroscopic characterization, together with the molecular and supramolecular structures of three products and one intermediate
Acta Crystallographica Section C, 2018, 74
2021024 CIF
HKL
Paper
C22 H21 N5P 1 21/c 19.425; 11.184; 17.321
90; 101.091; 90
1791.7Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise, efficient and versatile synthesis of amino-substituted benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepines: synthesis and spectroscopic characterization, together with the molecular and supramolecular structures of three products and one intermediate
Acta Crystallographica Section C, 2018, 74
2021025 CIF
HKL
Paper
C21 H19.748 N5 O0.374P 1 21/c 111.1086; 8.7806; 17.7753
90; 103.651; 90
1684.83Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise, efficient and versatile synthesis of amino-substituted benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepines: synthesis and spectroscopic characterization, together with the molecular and supramolecular structures of three products and one intermediate
Acta Crystallographica Section C, 2018, 74
2021026 CIF
HKL
Paper
C24 H25 N5P -19.7866; 10.2122; 10.9551
97.816; 112.433; 94.149
993.4Acosta Quintero, Lina M.; Burgos, Isidro; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
A concise, efficient and versatile synthesis of amino-substituted benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepines: synthesis and spectroscopic characterization, together with the molecular and supramolecular structures of three products and one intermediate
Acta Crystallographica Section C, 2018, 74
2021027 CIF
HKL
Paper
Cl4 ZrP c a 216.2199; 7.3301; 11.9153
90; 90; 90
543.25Borjas Nevarez, Rosendo; Balasekaran, Samundeeswari Mariappan; Kim, Eunja; Weck, Philippe; Poineau, Frederic
Zirconium tetrachloride revisited
Acta Crystallographica Section C, 2018, 74
2021028 CIF
HKL
Paper
Cl4 ZrP c a 216.2311; 7.3497; 11.9462
90; 90; 90
547.1Borjas Nevarez, Rosendo; Balasekaran, Samundeeswari Mariappan; Kim, Eunja; Weck, Philippe; Poineau, Frederic
Zirconium tetrachloride revisited
Acta Crystallographica Section C, 2018, 74
2021029 CIF
HKL
Paper
Cl4 ZrP c a 216.2389; 7.3667; 11.9735
90; 90; 90
550.3Borjas Nevarez, Rosendo; Balasekaran, Samundeeswari Mariappan; Kim, Eunja; Weck, Philippe; Poineau, Frederic
Zirconium tetrachloride revisited
Acta Crystallographica Section C, 2018, 74
2021030 CIF
HKL
Paper
Cl4 ZrP c a 216.253; 7.383; 12.017
90; 90; 90
554.8Borjas Nevarez, Rosendo; Balasekaran, Samundeeswari Mariappan; Kim, Eunja; Weck, Philippe; Poineau, Frederic
Zirconium tetrachloride revisited
Acta Crystallographica Section C, 2018, 74
2021031 CIF
HKL
Paper
Cl4 ZrP c a 216.262; 7.402; 12.039
90; 90; 90
558Borjas Nevarez, Rosendo; Balasekaran, Samundeeswari Mariappan; Kim, Eunja; Weck, Philippe; Poineau, Frederic
Zirconium tetrachloride revisited
Acta Crystallographica Section C, 2018, 74
2021032 CIF
HKL
Paper
C34 H52 Cu N14 O14 S2P b a 213.711; 19.1598; 8.9327
90; 90; 90
2346.6Li, Peng-Cheng; Zhang, Kou-Lin
A new copper(II) supramolecular coordination polymer and a dinuclear compound with multifunctional 2-amino-5-sulfobenzoic acid and flexible N-donor ligands: synthesis, structure and characterization
Acta Crystallographica Section C, 2018, 74
2021033 CIF
HKL
Paper
C42 H48 Cu2 N10 O15 S2P 1 21/c 118.787; 12.0409; 20.699
90; 99.905; 90
4612.6Li, Peng-Cheng; Zhang, Kou-Lin
A new copper(II) supramolecular coordination polymer and a dinuclear compound with multifunctional 2-amino-5-sulfobenzoic acid and flexible N-donor ligands: synthesis, structure and characterization
Acta Crystallographica Section C, 2018, 74
2021034 CIF
HKL
Paper
C36 H30 I2 P2 ZnP 1 21/c 119.3126; 10.2713; 18.1414
90; 112.052; 90
3335.4Chen, Di; Wang, Qiu-Hua; Chai, Wen-Xiang; Song, Li
Three zinc iodide complexes based on phosphane ligands: syntheses, structures, optical properties and TD‒DFT calculations
Acta Crystallographica Section C, 2018, 74
2021035 CIF
HKL
Paper
C42 H42 I2 P2 ZnF 2 d d11.3104; 19.3208; 37.933
90; 90; 90
8289.3Chen, Di; Wang, Qiu-Hua; Chai, Wen-Xiang; Song, Li
Three zinc iodide complexes based on phosphane ligands: syntheses, structures, optical properties and TD‒DFT calculations
Acta Crystallographica Section C, 2018, 74
2021036 CIF
HKL
Paper
C75 H66 I4 O6 P6 Zn2P 1 21/c 118.982; 15.9507; 24.9714
90; 90.352; 90
7560.6Chen, Di; Wang, Qiu-Hua; Chai, Wen-Xiang; Song, Li
Three zinc iodide complexes based on phosphane ligands: syntheses, structures, optical properties and TD‒DFT calculations
Acta Crystallographica Section C, 2018, 74
2021037 CIF
HKL
Paper
C38 H26 N10 Ni O4 SP 21 21 219.8015; 20.9572; 21.7012
90; 90; 90
4457.7Harvey, Miguel Angel; Suarez, Sebastián; Zolotarev, Pavel N.; Proserpio, Davide M.; Baggio, Ricardo
Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion
Acta Crystallographica Section C, 2018, 74
2021038 CIF
HKL
Paper
C38 H26 N10 Ni O4 SI -428.596; 28.596; 13.5438
90; 90; 90
11075.2Harvey, Miguel Angel; Suarez, Sebastián; Zolotarev, Pavel N.; Proserpio, Davide M.; Baggio, Ricardo
Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion
Acta Crystallographica Section C, 2018, 74
2021039 CIF
HKL
Paper
C41 H41.5 N11 Ni O9.25 SP c c n13.406; 24.365; 28.114
90; 90; 90
9183Harvey, Miguel Angel; Suarez, Sebastián; Zolotarev, Pavel N.; Proserpio, Davide M.; Baggio, Ricardo
Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion
Acta Crystallographica Section C, 2018, 74
2021040 CIF
HKL
Paper
C8 H4 Cl N O3P n a 2124.3852; 6.0502; 5.1
90; 90; 90
752.4Pogoda, Dorota; Matera-Witkiewicz, Agnieszka; Listowski, Marcin; Janczak, Jan; Videnova-Adrabinska, Veneta
The role of different nonspecific interactions and halogen contacts in the crystal structure organization of 5-chloroisatoic anhydride
Acta Crystallographica Section C, 2018, 74
2021041 CIF
HKL
Paper
C0.86 Al0.24 Li0.24 Mg1.52P -6 m 23.197; 3.197; 5.1943
90; 90; 120
45.977Pavlyuk, Volodymyr; Kulawik, Damian; Ciesielski, Wojciech; Pavlyuk, Nazar; Dmytriv, Grygoriy
New quaternary carbide Mg~1.52~Li~0.24~Al~0.24~C~0.86~ as a disorder derivative of the family of hexagonal close-packed (hcp) structures and the effect of structure modification on the electrochemical behaviour of the electrode
Acta Crystallographica Section C, 2018, 74
2021042 CIF
HKL
Paper
C20 H16 N2 O16 S2 U2P -16.9406; 8.5527; 12.7193
108.581; 90.93; 92.396
714.7Cui, Wen; Wang, Ruyu; Shu, Xi; Fan, Yu; Liu, Yang; Jin, Yongdong; Xia, Chuanqin; Huang, Chao
Hydrothermal synthesis, crystal structure and properties of a two-dimensional uranyl coordination polymer based on a flexible zwitterionic ligand
Acta Crystallographica Section C, 2018, 74
2021043 CIF
HKL
Paper
C56 H78 N4 O37 Tb4P 1 21/n 19.3676; 17.6232; 11.3172
90; 94.351; 90
1862.9Hao, Hongguo; Wang, Yuchen; Yuan, Suxian; Li, Dacheng; Sun, Junshan
Two novel lanthanide(III) organic frameworks based on a biphenyltetracarboxylate ligand: synthesis, structure and magnetic and luminescence properties
Acta Crystallographica Section C, 2018, 74
2021044 CIF
HKL
Paper
C56 H76 Eu4 N4 O36P 1 21/n 19.4453; 17.7439; 11.3019
90; 94.278; 90
1888.9Hao, Hongguo; Wang, Yuchen; Yuan, Suxian; Li, Dacheng; Sun, Junshan
Two novel lanthanide(III) organic frameworks based on a biphenyltetracarboxylate ligand: synthesis, structure and magnetic and luminescence properties
Acta Crystallographica Section C, 2018, 74
2021045 CIF
HKL
Paper
C12 H15 N5 O3P 43 21 27.559; 7.559; 44.103
90; 90; 90
2520Wang, Xiaojuan; Xu, Hai-Jiang; Jia, Xue-Dong; Yang, Yan-Tao; Zhang, Xiao-Jian
Crystal structure and Hirshfeld surface analysis of the anhydrous form of the nucleoside analogue entecavir
Acta Crystallographica Section C, 2018, 74
2021046 CIF
HKL
Paper
C11 H15 N5 SP 1 21/n 111.4343; 7.7435; 14.5125
90; 108.109; 90
1221.31Szczesio, Małgorzata; Gołka, Jolanta; Korona-Głowniak, Izabela; Orlewska, Czesława; Gobis, Katarzyna; Olczak, Andrzej
Planarity of heteroaryldithiocarbazic acid derivatives showing tuberculostatic activity: structure‒activity relationships
Acta Crystallographica Section C, 2018, 74
2021047 CIF
HKL
Paper
C8 H10 N4 S2P 1 21/n 17.2793; 19.962; 7.4299
90; 105.205; 90
1041.8Szczesio, Małgorzata; Gołka, Jolanta; Korona-Głowniak, Izabela; Orlewska, Czesława; Gobis, Katarzyna; Olczak, Andrzej
Planarity of heteroaryldithiocarbazic acid derivatives showing tuberculostatic activity: structure‒activity relationships
Acta Crystallographica Section C, 2018, 74
2021048 CIF
HKL
Paper
C9 H12 N4 S2P -17.323; 8.5983; 10.0343
79.167; 71.019; 84.08
586.21Szczesio, Małgorzata; Gołka, Jolanta; Korona-Głowniak, Izabela; Orlewska, Czesława; Gobis, Katarzyna; Olczak, Andrzej
Planarity of heteroaryldithiocarbazic acid derivatives showing tuberculostatic activity: structure‒activity relationships
Acta Crystallographica Section C, 2018, 74
2021049 CIF
HKL
Paper
C6 H8 N4P 1 21/c 16.9312; 14.6542; 7.1239
90; 114.011; 90
660.97Kassim, Muhammad Arif; Yassin, Ubaidullah H. M.; Tan, Ai Ling; Usman, Anwar; Hamid, Malai Haniti S. A.
[1-(Pyrazin-2-yl)ethylidene]hydrazine: a new multitopic ligand for the design of hybrid molecular frameworks
Acta Crystallographica Section C, 2018, 74
2021050 CIF
HKL
Paper
C32 H28 Co2 O18P -110.7964; 10.9649; 14.3692
96.412; 110.682; 92.9
1574.03An, Yan-Yan; Lu, Li-Ping; Zhu, Miao-Li
A three-dimensional twofold interpenetrated cobalt(II) MOF containing a flexible carboxylate-based ligand: synthesis, structure and magnetic properties
Acta Crystallographica Section C, 2018, 74
2021051 CIF
HKL
Paper
C6 H9 N3 OP 1 21/c 19.6552; 10.7203; 7.448
90; 108.605; 90
730.63Strey, Mark; Jones, Peter G.
Pyridine 1:1 adducts of urea (Z′ = 1) and thiourea (Z′ = 8)
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021052 CIF
HKL
Paper
C6 H9 N3 SP 1 21/n 122.115; 8.4863; 34.1306
90; 95.778; 90
6372.9Strey, Mark; Jones, Peter G.
Pyridine 1:1 adducts of urea (Z′ = 1) and thiourea (Z′ = 8)
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021053 CIF
HKL
Paper
C34 H30 Cl2 N2 O2P 1 21/n 19.67404; 10.9707; 13.5552
90; 94.738; 90
1433.71Shin, In-Sub; Shimada, Yuta; Horiguchi-Babamoto, Emi; Matsumoto, Shinya
Two polymorphs of 2,5-dichloro-3,6-bis(dibenzylamino)-<i>p</i>-hydroquinone with flexible dibenzylamino groups
Acta Crystallographica Section C, 2018, 74
2021054 CIF
HKL
Paper
C34 H30 Cl2 N2 O2P b c a13.2054; 12.4456; 16.8489
90; 90; 90
2769.1Shin, In-Sub; Shimada, Yuta; Horiguchi-Babamoto, Emi; Matsumoto, Shinya
Two polymorphs of 2,5-dichloro-3,6-bis(dibenzylamino)-<i>p</i>-hydroquinone with flexible dibenzylamino groups
Acta Crystallographica Section C, 2018, 74
2021055 CIF
HKL
Paper
Ca2 Cd2 Na O12 V3I a -3 d12.7576; 12.7576; 12.7576
90; 90; 90
2076.38Tokuda, Makoto; Yoshiasa, Akira; Mashimo, Tsutomu; Iishi, Kazuake; Nakatsuka, Akihiko
The vanadate garnet Ca~2~NaCd~2~V~3~O~12~: a single-crystal X-ray diffraction study
Acta Crystallographica Section C, 2018, 74
2021056 CIF
HKL
Paper
C19 H16 B2 N2 O4P 1 21/c 114.2967; 11.5113; 11.0913
90; 105.465; 90
1759.2Cárdenas-Valenzuela, A. Jaquelin; Baldenebro-López, Jesús; Guerrero-Álvarez, Jorge A.; Höpfl, Herbert; Glossman-Mitnik, Daniel; Campos-Gaxiola, José J.; Cruz-Enríquez, Adriana
Supramolecular arrangement and photophysical properties of a dinuclear cyanophenylboronic acid ester
Acta Crystallographica Section C, 2018, 74
2021057 CIF
HKL
Paper
C10 H13 Li N4 O4 SC 1 c 111.5095; 12.0788; 9.5184
90; 91.063; 90
1323.03Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021058 CIF
HKL
Paper
C10 H9 N4 Na O2 SP 1 21/c 15.901; 10.534; 18.389
90; 94.216; 90
1140Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021059 CIF
HKL
Paper
C10 H13 K N4 O4 SP -18.8503; 9.6385; 15.9734
92.35; 95.186; 94.209
1351.79Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021060 CIF
HKL
Paper
C26 H32 N6 Na O14.5 S3P 1 21/c 112.7688; 16.904; 15.7411
90; 107.609; 90
3238.42Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021061 CIF
HKL
Paper
C15 H16 N6 O2 SP 1 21/c 18.5796; 19.0371; 11.2512
90; 121.116; 90
1573.27Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021062 CIF
HKL
Paper
C12 H19 N5 O4 SP 1 21/c 112.7755; 9.8979; 11.5366
90; 93.508; 90
1456.08Campbell, Gemma; Fisher, Rebecca; Kennedy, Alan R.; King, Nathan L. C.; Spiteri, Rebecca
Salt forms of sulfadiazine with alkali metal and organic cations
Acta Crystallographica Section C, 2018, 74
2021063 CIF
HKL
Paper
C13 H10 O2P b c a15.0087; 13.8489; 19.52
90; 90; 90
4057.3Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2021064 CIF
HKL
Paper
C15 H15 N OP 21 21 217.7442; 11.773; 26.2562
90; 90; 90
2393.84Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2021065 CIF
HKL
Paper
C15 H14 OP 32 2 19.4796; 9.4796; 11.164
90; 90; 120
868.8Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2021066 CIF
HKL
Paper
C15 H14 OP 21 21 2112.1952; 7.8601; 12.0734
90; 90; 90
1157.3Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2021067 CIF
HKL
Paper
C15 H14 OP 1 21/c 125.369; 6.031; 15.256
90; 97.788; 90
2312.6Soqaka, Antonia A.; Esterhuysen, Catharine; Lemmerer, Andreas
Prevalent polymorphism in benzophenones
Acta Crystallographica Section C, 2018, 74
2021068 CIF
HKL
Paper
C19 H20 Cl2 N4 O5 SP 1 21/n 17.003; 28.2985; 11.507
90; 106.08; 90
2191.2Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021069 CIF
HKL
Paper
C19 H23 Br N4 O6 SP 1 21/c 116.944; 6.8991; 19.7206
90; 109.773; 90
2169.4Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021070 CIF
HKL
Paper
C19 H23 Cl N4 O6 SP 1 21/c 116.973; 6.8689; 19.6051
90; 109.321; 90
2156.95Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021071 CIF
HKL
Paper
C20 H26 N4 O6 SP -16.9417; 9.8281; 16.2754
90.813; 90.376; 99.084
1096.29Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021072 CIF
HKL
Paper
C29 H31 N4 O6.5P -111.168; 16.1913; 16.2434
106.203; 101.386; 90.029
2760.2Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021073 CIF
HKL
Paper
C17 H15 Cl3 N4 O2 SP -19.3415; 10.2751; 11.373
63.919; 85.243; 83.689
973.8Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021074 CIF
HKL
Paper
C17 H16 Br Cl N4 O2 SC 1 2/c 117.0836; 15.8893; 16.4764
90; 116.538; 90
4001.2Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021075 CIF
HKL
Paper
C29 H31 Cl N4 O4P 1 21/n 19.5195; 15.7842; 18.8336
90; 92.293; 90
2827.6Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021076 CIF
HKL
Paper
C34 H34 Cl2 N8 O6 S2P -110.7421; 11.7053; 24.5947
85.45; 87.699; 63.459
2757.86Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular hydrogen-bonding patterns in salts of the antifolate drugs trimethoprim and pyrimethamine
Acta Crystallographica Section C, 2018, 74
2021077 CIF
HKL
Paper
C30 H20 O2P 1 21/n 112.9627; 9.6666; 16.6887
90; 105.217; 90
2017.86Zarei, Seyed Amir; Akhtari, Keivan; Piltan, Mohammad; Kamel, Shaaban M.; Mague, Joel T.
The [4+4] thermocyclization of 9-anthraldehyde: synthesis, crystal structure, experimental and theoretical UV spectra, natural bonding orbital analysis and prediction of third-order nonlinear optical properties
Acta Crystallographica Section C, 2018, 74
2021079 CIF
HKL
Paper
C36 H41.5 Br3 Co N9 O9.75P -110.6773; 13.0608; 16.356
71.118; 87.07; 80.73
2130Su, Chang-Kai; Zhang, Kou-Lin
Two new Co^II^ coordination polymers with multifunctional 5-amino-2,4,6-tribromoisophthalic acid and flexible isomeric bis(imidazole) ligands: preparation, crystal structure and characterization
Acta Crystallographica Section C, 2018, 74, 504-512
2021080 CIF
HKL
Paper
C22 H16 Br3 Co N5 O4P b c a10.1342; 17.938; 28.071
90; 90; 90
5103Su, Chang-Kai; Zhang, Kou-Lin
Two new Co^II^ coordination polymers with multifunctional 5-amino-2,4,6-tribromoisophthalic acid and flexible isomeric bis(imidazole) ligands: preparation, crystal structure and characterization
Acta Crystallographica Section C, 2018, 74, 504-512
2021081 CIF
HKL
Paper
C17 H14 F3 N3P 1 21/n 110.001; 20.82; 15.124
90; 96.12; 90
3131Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021082 CIF
HKL
Paper
C18 H16 F3 N3 OP b c a9.5097; 17.921; 20.011
90; 90; 90
3410.3Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021083 CIF
HKL
Paper
C18 H16 F3 N3 OP 1 21/n 115.1368; 7.7224; 15.4446
90; 112.454; 90
1668.5Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021084 CIF
HKL
Paper
C18 H16 F3 N3 OP -18.829; 9.513; 11.598
106.105; 95.554; 110.049
859.1Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021085 CIF
HKL
Paper
C18 H10 F9 N3 OP 1 21/n 111.9633; 7.8453; 20.0446
90; 95.191; 90
1873.6Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021086 CIF
HKL
Paper
C19 H18 F3 N3 O4P 1 21/c 130.656; 8.3363; 7.6723
90; 94.627; 90
1954.3Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021087 CIF
HKL
Paper
C17 H14 F3 N3 O3P 1 21/c 112.267; 8.4334; 15.686
90; 93.904; 90
1619Farrán, M. Ángeles; Bonet, M. Ángels; Claramunt, Rosa M.; Torralba, M. Carmen; Alkorta, Ibon; Elguero, José
The structures of 1,4-diaryl-5-trifluoromethyl-1<i>H</i>-1,2,3-triazoles related to J147, a drug for treating Alzheimer's disease
Acta Crystallographica Section C, 2018, 74, 513-522
2021088 CIF
HKL
C16 H8 Mn N4 O8P 1 21/c 18.3422; 16.45; 11.8773
90; 93.108; 90
1627.51Liu, Yan-Ju; Cheng, Di; Li, Ya-Xue; Meng, Xiang-Ru; Yang, Huai-Xia
A new two-dimensional managnese(II) coordination polymer constructed by 2,2'-(1,2-phenylene)bis(1<i>H</i>-imidazole-4,5-dicarboxylate)
Acta Crystallographica Section C, 2018, 74, 599-603
2021089 CIF
HKL
Paper
C23 H17 Cl N6 O2P 1 21/c 111.8203; 9.1276; 21.1575
90; 100.468; 90
2244.71Potočňák, Ivan; Bukrynov, Oleksandr; Kliuikov, Andrii; Čižmár, Erik; Vitushkina, Svitlana; Váhovská, Lucia; Dušek, Michal
A Cu^II^ complex with an carbamoylcyanonitrosomethanide ligand formed <i>in situ</i> by the nucleophilic addition of water to dicyanonitrosomethanide: structure, spectral and magnetic properties
Acta Crystallographica Section C, 2018, 74, 584-589
2021090 CIF
Paper
C38 H36 As Cl O2 Pb2P b c a19.0566; 15.5255; 24.0975
90; 90; 90
7129.6Shihada, Abdel-Fattah; Weller, Frank; Massa, Werner
Between MOFs and molecules: organolead(IV) compounds with chain structures
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021091 CIF
Paper
C14 H16 As Cl O2 PbP 1 21/c 17.3822; 19.95; 10.2878
90; 99.763; 90
1493.19Shihada, Abdel-Fattah; Weller, Frank; Massa, Werner
Between MOFs and molecules: organolead(IV) compounds with chain structures
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021092 CIF
Paper
C30 H25 O2 P PbP 1 21/n 113.8277; 12.6242; 14.4713
90; 97.717; 90
2503.3Shihada, Abdel-Fattah; Weller, Frank; Massa, Werner
Between MOFs and molecules: organolead(IV) compounds with chain structures
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021093 CIF
HKL
Paper
C20 H32 O5P 21 21 216.4641; 11.6518; 25.4249
90; 90; 90
1914.96Zhao, Chen-Liang; Sarwar, Md. Shahid; Ye, Jiang-Hai; Ku, Chuen Fai; Li, Wan-Fei; Luo, Guo-Yong; Zhang, Jing-Jie; Xu, Jun; Huang, Zhao-Feng; Tsang, Siu Wai; Pan, Lu-Tai; Zhang, Hong-Jie
Isolation, evaluation of bioactivity and structure determination of amethinol A, a prototypic amethane diterpene from <i>Isodon amethystoides</i> bearing a six/five/seven-membered carbon-ring system
Acta Crystallographica Section C, 2018, 74, 635-640
2021094 CIF
HKL
Paper
C23 H24 F2 N3 O2 PP 19.7608; 10.6134; 11.2721
77.398; 75.589; 87.635
1103.64Eghbali Toularoud, Mahsa; Pourayoubi, Mehrdad; Dušek, Michal; Eigner, Václav; Damodaran, Krishnan
Chiral one-dimensional hydrogen-bonded architectures constructed from single-enantiomer phosphoric triamides
Acta Crystallographica Section C, 2018, 74, 608-617
2021095 CIF
HKL
Paper
C23 H24 F2 N3 O2 PP 19.7524; 10.6117; 11.251
77.3381; 75.6221; 87.7313
1100.33Eghbali Toularoud, Mahsa; Pourayoubi, Mehrdad; Dušek, Michal; Eigner, Václav; Damodaran, Krishnan
Chiral one-dimensional hydrogen-bonded architectures constructed from single-enantiomer phosphoric triamides
Acta Crystallographica Section C, 2018, 74, 608-617
2021096 CIF
HKL
Paper
C52 H119 N20 Na5 O60 P8C 1 2 137.656; 7.031; 21.959
90; 120.9; 90
4989Otreba, Marta; Budzikur, Daria; Górecki, Łukasz; Ślepokura, Katarzyna A.
Adenosine hypodiphosphate ester, an analogue of ADP: analysis of the adenine‒hypodiphosphate interaction mode in hypodiphosphate nucleotides and adenine salts
Acta Crystallographica Section C, 2018, 74, 571-583
2021097 CIF
HKL
Paper
C52 H105 N20 Na O51 P8C 1 2 139.474; 6.964; 18.656
90; 115.18; 90
4641Otreba, Marta; Budzikur, Daria; Górecki, Łukasz; Ślepokura, Katarzyna A.
Adenosine hypodiphosphate ester, an analogue of ADP: analysis of the adenine‒hypodiphosphate interaction mode in hypodiphosphate nucleotides and adenine salts
Acta Crystallographica Section C, 2018, 74, 571-583
2021098 CIF
HKL
Paper
C10 H18 N10 O8 P2P 1 21/c 110.515; 11.955; 7.064
90; 96.62; 90
882.1Otreba, Marta; Budzikur, Daria; Górecki, Łukasz; Ślepokura, Katarzyna A.
Adenosine hypodiphosphate ester, an analogue of ADP: analysis of the adenine‒hypodiphosphate interaction mode in hypodiphosphate nucleotides and adenine salts
Acta Crystallographica Section C, 2018, 74, 571-583
2021099 CIF
HKL
Paper
C10 H14 N10 O6 P2C 1 2/c 112.888; 11.093; 11.487
90; 101.44; 90
1609.6Otreba, Marta; Budzikur, Daria; Górecki, Łukasz; Ślepokura, Katarzyna A.
Adenosine hypodiphosphate ester, an analogue of ADP: analysis of the adenine‒hypodiphosphate interaction mode in hypodiphosphate nucleotides and adenine salts
Acta Crystallographica Section C, 2018, 74, 571-583
2021100 CIF
HKL
Paper
As Nb0.92 NiP n m a6.2115; 3.715; 7.172
90; 90; 90
165.5Baranets, Sviatoslav; He, Hua; Bobev, Svilen
Niobium-bearing arsenides and germanides from elemental mixtures not involving niobium: a new twist to an old problem in solid-state synthesis
Acta Crystallographica Section C, 2018, 74, 623-627
2021101 CIF
HKL
Paper
As Co NbP n m a6.2656; 3.7273; 7.1589
90; 90; 90
167.19Baranets, Sviatoslav; He, Hua; Bobev, Svilen
Niobium-bearing arsenides and germanides from elemental mixtures not involving niobium: a new twist to an old problem in solid-state synthesis
Acta Crystallographica Section C, 2018, 74, 623-627
2021102 CIF
HKL
Paper
Ge Nb NiP n m a6.2989; 3.7613; 7.2033
90; 90; 90
170.66Baranets, Sviatoslav; He, Hua; Bobev, Svilen
Niobium-bearing arsenides and germanides from elemental mixtures not involving niobium: a new twist to an old problem in solid-state synthesis
Acta Crystallographica Section C, 2018, 74, 623-627
2021103 CIF
HKL
Paper
C38 H62 Mg O4P 1 21 116.847; 15.6786; 21.787
90; 106.954; 90
5504.7Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Shlyakhtin, Andrey V.; Ivchenko, Pavel V.; Lyssenko, Konstantin A.
Phenoxide and alkoxide complexes of Mg, Al and Zn, and their use for the ring-opening polymerization of ε-caprolactone with initiators of different natures
Acta Crystallographica Section C, 2018, 74, 548-557
2021104 CIF
HKL
Paper
C40 H66 Al2 O8C 1 2/c 127.7603; 9.0454; 18.4921
90; 118.401; 90
4084.5Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Shlyakhtin, Andrey V.; Ivchenko, Pavel V.; Lyssenko, Konstantin A.
Phenoxide and alkoxide complexes of Mg, Al and Zn, and their use for the ring-opening polymerization of ε-caprolactone with initiators of different natures
Acta Crystallographica Section C, 2018, 74, 548-557
2021105 CIF
HKL
Paper
C68 H86 O8 Zn7P b c a13.9163; 20.4248; 23.0316
90; 90; 90
6546.4Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Shlyakhtin, Andrey V.; Ivchenko, Pavel V.; Lyssenko, Konstantin A.
Phenoxide and alkoxide complexes of Mg, Al and Zn, and their use for the ring-opening polymerization of ε-caprolactone with initiators of different natures
Acta Crystallographica Section C, 2018, 74, 548-557
2021106 CIF
HKL
Paper
Cl3 Cu RbC 2 2 217.053; 11.864; 11.785
90; 90; 90
986.1Kornyakov, Ilya V.; Krivovichev, Sergey V.; Gurzhiy, Vladislav V.; Leoni, Matteo
ε-RbCuCl~3~, a new polymorph of rubidium copper trichloride: synthesis, structure and structural complexity
Acta Crystallographica Section C, 2018, 74, 529-533
2021107 CIF
HKL
Paper
C16 H35 N7 O7P 1 21/n 19.7361; 13.7118; 16.1437
90; 92.249; 90
2153.52Jurek, Paul; Kiefer, Garry E.; Fronczek, Frank R.
Crystal structures of two polymorphic forms of DOTAM-mono-acid dihydrate
Acta Crystallographica Section C, 2018, 74, 542-547
2021108 CIF
HKL
Paper
C16 H35 N7 O7P 1 21 18.807; 14.9505; 16.6376
90; 95.903; 90
2179Jurek, Paul; Kiefer, Garry E.; Fronczek, Frank R.
Crystal structures of two polymorphic forms of DOTAM-mono-acid dihydrate
Acta Crystallographica Section C, 2018, 74, 542-547
2021109 CIF
HKL
Paper
Bi5 La3 TiP 63/m c m9.6871; 9.6871; 6.4528
90; 90; 120
524.4Ovchinnikov, Alexander; Bobev, Svilen
Undistorted linear Bi chains with hypervalent bonding in La~3~TiBi~5~ from single-crystal X-ray diffraction
Acta Crystallographica Section C, 2018, 74, 618-622
2021110 CIF
HKL
Paper
C78 H126 La O18 P3P 1 21/c 123.511; 10.6098; 33.8618
90; 92.1502; 90
8440.8Minyaev, Mikhail E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Bondarenko, Galina N.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Isomorphous rare-earth tris[bis(2,6-diisopropylphenyl) phosphate] complexes and their catalytic properties in 1,3-diene polymerization and in the inhibited oxidation of polydimethylsiloxane
Acta Crystallographica Section C, 2018, 74, 590-598
2021111 CIF
HKL
Paper
C78 H126 Ce O18 P3P 1 21/c 123.578; 10.6366; 33.808
90; 92.022; 90
8473.4Minyaev, Mikhail E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Bondarenko, Galina N.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Isomorphous rare-earth tris[bis(2,6-diisopropylphenyl) phosphate] complexes and their catalytic properties in 1,3-diene polymerization and in the inhibited oxidation of polydimethylsiloxane
Acta Crystallographica Section C, 2018, 74, 590-598
2021112 CIF
HKL
Paper
C78 H126 Nd O18 P3P 1 21/c 123.5159; 10.6376; 33.6934
90; 92.038; 90
8423.2Minyaev, Mikhail E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Bondarenko, Galina N.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Isomorphous rare-earth tris[bis(2,6-diisopropylphenyl) phosphate] complexes and their catalytic properties in 1,3-diene polymerization and in the inhibited oxidation of polydimethylsiloxane
Acta Crystallographica Section C, 2018, 74, 590-598
2021113 CIF
HKL
C18 H24 O4P 1 21 16.143; 8.4833; 14.767
90; 91.94; 90
769.1Shahid, Ammara; Aziz, Ambreen; Noureen, Sajida; Ahmed, Maqsood; Yousuf, Sammer; Choudhary, Muhammad Iqbal
Biotransformation, spectroscopic investigation, crystal structure and electrostatic properties of 3,7α-dihydroxyestra-1,3,5(10)-trien-17-one monohydrate studied using transferred electron-density parameters
Acta Crystallographica Section C, 2018, 74, 534-541
2021114 CIFC18 H24 O4P 1 21 16.143; 8.4833; 14.767
90; 91.94; 90
769.1Shahid, Ammara; Aziz, Ambreen; Noureen, Sajida; Ahmed, Maqsood; Yousuf, Sammer; Choudhary, Muhammad Iqbal
Biotransformation, spectroscopic investigation, crystal structure and electrostatic properties of 3,7α-dihydroxyestra-1,3,5(10)-trien-17-one monohydrate studied using transferred electron-density parameters
Acta Crystallographica Section C, 2018, 74, 534-541
2021115 CIF
HKL
C18 H24 O4P 1 21 16.143; 8.4833; 14.767
90; 91.94; 90
769.1Shahid, Ammara; Aziz, Ambreen; Noureen, Sajida; Ahmed, Maqsood; Yousuf, Sammer; Choudhary, Muhammad Iqbal
Biotransformation, spectroscopic investigation, crystal structure and electrostatic properties of 3,7α-dihydroxyestra-1,3,5(10)-trien-17-one monohydrate studied using transferred electron-density parameters
Acta Crystallographica Section C, 2018, 74, 534-541
2021118 CIF
HKL
Paper
C18 H20 B N O6P -19.05; 10.006; 11.082
69.207; 79.497; 82.267
919.8Hadjadj, Nasreddine; Dems, Mohamed AbdEsselem; Merazig, Hocine; Bendjeddou, Lamia
Synthesis, structure characterization, photoluminescence properties and TD‒DFT calculations for two new borates
Acta Crystallographica Section C, 2018, 74, 411-417
2021119 CIF
HKL
C17 H18 B N O6P 1 21/c 111.529; 8.885; 17.216
90; 108.308; 90
1674.3Hadjadj, Nasreddine; Dems, Mohamed AbdEsselem; Merazig, Hocine; Bendjeddou, Lamia
Synthesis, structure characterization, photoluminescence properties and TD‒DFT calculations for two new borates
Acta Crystallographica Section C, 2018, 74, 411-417
2021120 CIF
HKL
Paper
C14 H14 N8 OP 1 21/c 15.8043; 31.562; 7.898
90; 95.86; 90
1439.3Chen, Xiang; Zhang, Cong; Bai, Yang; Guo, Zhaoqi; Yao, Yanru; Song, Jirong; Ma, Haixia
Synthesis, crystal structure and thermal properties of an unsymmetrical 1,2,4,5-tetrazine energetic derivative
Acta Crystallographica Section C, 2018, 74
2021121 CIF
HKL
Paper
C7 H11 Cl N2 O2P 1 21/n 110.2225; 9.6736; 10.2678
90; 112.165; 90
940.3Prodius, Denis; Wilk-Kozubek, Magdalena; Mudring, Anja-Verena
Synthesis, structural characterization and luminescence properties of 1-carboxymethyl-3-ethylimidazolium chloride
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021122 CIF
HKL
Paper
C24 H26 F N OP 1 21/c 113.4219; 8.3679; 18.5974
90; 98.348; 90
2066.6Yao, Binrong; Li, Ning; Wang, Chunhua; Hou, Guige; Meng, Qingguo; Yan, Ke
Novel asymmetric 3,5-bis(arylidene)piperidin-4-one derivatives: synthesis, crystal structures and cytotoxicity
Acta Crystallographica Section C, 2018, 74
2021123 CIF
HKL
Paper
C26 H31 N O3P 1 21/c 119.1378; 16.2788; 7.5525
90; 98.386; 90
2327.8Yao, Binrong; Li, Ning; Wang, Chunhua; Hou, Guige; Meng, Qingguo; Yan, Ke
Novel asymmetric 3,5-bis(arylidene)piperidin-4-one derivatives: synthesis, crystal structures and cytotoxicity
Acta Crystallographica Section C, 2018, 74
2021124 CIF
HKL
Paper
C27 H23 F N2 O3P -17.0689; 8.2072; 20.1397
94.401; 97.829; 106.575
1101.18Yao, Binrong; Li, Ning; Wang, Chunhua; Hou, Guige; Meng, Qingguo; Yan, Ke
Novel asymmetric 3,5-bis(arylidene)piperidin-4-one derivatives: synthesis, crystal structures and cytotoxicity
Acta Crystallographica Section C, 2018, 74
2021125 CIF
HKL
Paper
C132 H203 La2 O23 P5P 1 21/n 127.4921; 16.9467; 30.909
90; 106.801; 90
13785.8Minyaev, Mikhail E.; Korchagina, Sof'ya A.; Tavtorkin, Alexander N.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Dinuclear neodymium and lanthanum bis(2,6-diisopropylphenyl) phosphate complexes bearing a hydroxide ligand: catalytic activity of the Nd complex in 1,3-diene polymerization
Acta Crystallographica Section C, 2018, 74
2021126 CIF
HKL
Paper
C134 H211 Nd2 O25 P5P -115.094; 17.491; 27.444
102.142; 95.211; 90.412
7052Minyaev, Mikhail E.; Korchagina, Sof'ya A.; Tavtorkin, Alexander N.; Churakov, Andrei V.; Nifant'ev, Ilya E.
Dinuclear neodymium and lanthanum bis(2,6-diisopropylphenyl) phosphate complexes bearing a hydroxide ligand: catalytic activity of the Nd complex in 1,3-diene polymerization
Acta Crystallographica Section C, 2018, 74
2021127 CIFC23 H31 Cl F N3 O5P 1 21/n 112.3225; 14.5183; 13.8141
90; 98.361; 90
2445.1Zhou, Xin-Bo; Zhu, Jian-Rong; Gu, Jian-Ming; Hu, Xiu-Rong
A new polymorph of the gastrokinetic drug cisapride monohydrate
Acta Crystallographica Section C, 2018, 74
2021128 CIF
HKL
Paper
C21 H24 N6 O3 SP 1 21/c 110.801; 17.301; 11.777
90; 104.28; 90
2132.7Cobo, Justo; Vicentes, Daniel E.; Rodríguez, Ricaurte; Marchal, Antonio; Glidewell, Christopher
A concise synthesis of a highly substituted 6-(1<i>H</i>-benzimidazol-1-yl)-5-nitrosopyrimidin-2-amine: synthetic sequence and the molecular and supramolecular structures of one product and two intermediates
Acta Crystallographica Section C, 2018, 74
2021129 CIF
HKL
Paper
C16 H22 N6 O4 SP 1 21/c 110.8498; 17.2238; 11.3806
90; 115.351; 90
1921.9Cobo, Justo; Vicentes, Daniel E.; Rodríguez, Ricaurte; Marchal, Antonio; Glidewell, Christopher
A concise synthesis of a highly substituted 6-(1<i>H</i>-benzimidazol-1-yl)-5-nitrosopyrimidin-2-amine: synthetic sequence and the molecular and supramolecular structures of one product and two intermediates
Acta Crystallographica Section C, 2018, 74
2021130 CIF
HKL
Paper
C14 H14 N4 O6P b c a6.7095; 13.7764; 30.7205
90; 90; 90
2839.6Mnguni, Malitsatsi J.; Michael, Joseph P.; Lemmerer, Andreas
Binary polymorphic cocrystals: an update on the available literature in the Cambridge Structural Database, including a new polymorph of the pharmaceutical 1:1 cocrystal theophylline‒3,4-dihydroxybenzoic acid
Acta Crystallographica Section C, 2018, 74
2021131 CIF
HKL
Paper
C4 H12 I3 N2 NaC 1 2/c 19.842; 9.309; 12.538
90; 93.45; 90
1146.6Chen, Xiao-Gang; Gao, Ji-Xing; Hua, Xiu-Ni; Liao, Wei-Qiang
Three-dimensional organic‒inorganic hybrid sodium halide perovskite: C~4~H~12~N~2~·NaI~3~ and a hydrogen-bonded supramolecular three-dimensional network in 3C~4~H~12~N~2~·NaI~4~·3I·H~2~O
Acta Crystallographica Section C, 2018, 74
2021132 CIF
HKL
Paper
C12 H38 I7 N6 Na OP 1 21/n 112.186; 22.828; 12.214
90; 111.89; 90
3152.7Chen, Xiao-Gang; Gao, Ji-Xing; Hua, Xiu-Ni; Liao, Wei-Qiang
Three-dimensional organic‒inorganic hybrid sodium halide perovskite: C~4~H~12~N~2~·NaI~3~ and a hydrogen-bonded supramolecular three-dimensional network in 3C~4~H~12~N~2~·NaI~4~·3I·H~2~O
Acta Crystallographica Section C, 2018, 74
2021133 CIF
HKL
Paper
C24 H31 N O6P 19.5552; 10.3175; 11.9645
91.085; 110.515; 93.998
1100.85Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Cocrystals of the antimalarial drug 11-azaartemisinin with three alkenoic acids of 1:1 or 2:1 stoichiometry
Acta Crystallographica Section C, 2018, 74
2021134 CIF
HKL
Paper
C19 H27 N O8P 21 21 219.62162; 10.40235; 19.6935
90; 90; 90
1971.07Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Cocrystals of the antimalarial drug 11-azaartemisinin with three alkenoic acids of 1:1 or 2:1 stoichiometry
Acta Crystallographica Section C, 2018, 74
2021135 CIF
HKL
Paper
C34 H50 N2 O12P 21 21 219.7885; 9.9965; 33.7661
90; 90; 90
3304.04Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Cocrystals of the antimalarial drug 11-azaartemisinin with three alkenoic acids of 1:1 or 2:1 stoichiometry
Acta Crystallographica Section C, 2018, 74
2021136 CIF
HKL
Paper
C34 H50 N2 O12P 1 21 19.57929; 10.05214; 17.7765
90; 96.4731; 90
1700.83Nisar, Madiha; Wong, Lawrence W.-Y.; Sung, Herman H.-Y.; Haynes, Richard K.; Williams, Ian D.
Cocrystals of the antimalarial drug 11-azaartemisinin with three alkenoic acids of 1:1 or 2:1 stoichiometry
Acta Crystallographica Section C, 2018, 74
2021137 CIF
HKL
Paper
C96 H156 Co2 N4 O21P 1 21/c 123.849; 11.679; 18.319
90; 95.28; 90
5080.8Drath, Olga; Gable, Robert W.; Boskovic, Colette
Structural investigation of one- and two-dimensional coordination polymers based on cobalt‒bis(dioxolene) units and 1-hydroxy-1,2,4,5-tetrakis(pyridin-4-yl)cyclohexane
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021138 CIF
HKL
Paper
C56 H80 Co N4 O11P -110.072; 16.135; 18.192
75.34; 83.15; 78.7
2797.1Drath, Olga; Gable, Robert W.; Boskovic, Colette
Structural investigation of one- and two-dimensional coordination polymers based on cobalt‒bis(dioxolene) units and 1-hydroxy-1,2,4,5-tetrakis(pyridin-4-yl)cyclohexane
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021139 CIF
HKL
Paper
C56 H80 Co N4 O11P -110.066; 16.124; 18.205
75.36; 83.11; 78.68
2795.5Drath, Olga; Gable, Robert W.; Boskovic, Colette
Structural investigation of one- and two-dimensional coordination polymers based on cobalt‒bis(dioxolene) units and 1-hydroxy-1,2,4,5-tetrakis(pyridin-4-yl)cyclohexane
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021140 CIF
HKL
Paper
C56 H76 Co N4 O9P -110.168; 16.321; 18.515
75.33; 82.77; 78.77
2906Drath, Olga; Gable, Robert W.; Boskovic, Colette
Structural investigation of one- and two-dimensional coordination polymers based on cobalt‒bis(dioxolene) units and 1-hydroxy-1,2,4,5-tetrakis(pyridin-4-yl)cyclohexane
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021141 CIF
HKL
Paper
C12 H16 Er O14.5 P4P 1 21/c 19.1557; 23.753; 10.379
90; 115.261; 90
2041.3Mendes, Ricardo F.; Firmino, Ana D. G.; Tomé, João P. C.; Almeida Paz, Filipe A.
Metal‒organic framework assembled from erbium and a tetrapodal polyphosphonic acid organic linker
Acta Crystallographica Section C, 2018, 74
2021142 CIF
HKL
Paper
C80 H96 Na O10 ScP -112.6071; 14.764; 18.585
84.507; 88.508; 84.033
3424.3Ellis, John E.; Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Churakov, Andrei V.
Scandium complexes with the tetraphenylethylene and anthracene dianions
Acta Crystallographica Section C, 2018, 74, 769-781
2021143 CIF
HKL
Paper
C17 H14P 1 21/n 17.3278; 5.944; 26.6551
90; 94.352; 90
1157.65Ellis, John E.; Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Churakov, Andrei V.
Scandium complexes with the tetraphenylethylene and anthracene dianions
Acta Crystallographica Section C, 2018, 74, 769-781
2021144 CIF
HKL
Paper
C50.5 H45 O ScC 1 2/c 136.06; 9.5557; 23.662
90; 113.84; 90
7457.7Ellis, John E.; Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Churakov, Andrei V.
Scandium complexes with the tetraphenylethylene and anthracene dianions
Acta Crystallographica Section C, 2018, 74, 769-781
2021145 CIF
HKL
Paper
C96 H96 K2 O5 Sc2I b a m18.1056; 19.9164; 21.8633
90; 90; 90
7883.9Ellis, John E.; Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Churakov, Andrei V.
Scandium complexes with the tetraphenylethylene and anthracene dianions
Acta Crystallographica Section C, 2018, 74, 769-781
2021146 CIF
HKL
Paper
C42 H32 N12 O12P -111.4603; 11.6052; 16.3587
92.862; 105.149; 97.497
2074.1Breton, Gary W.; Martin, Kenneth L.
Unanticipated formation of a novel octaazacyclodecane ring upon oxidation of a 1,1-bis-urazole
Acta Crystallographica Section C, 2018, 74, 558-563
2021147 CIF
HKL
Paper
C12 H15 N O5P c c n26.571; 6.9074; 13.5152
90; 90; 90
2480.5Manin, Alex N.; Voronin, Alexander P.; Drozd, Ksenia V.; Churakov, Andrei V.; Perlovich, German L.
Pharmaceutical salts of emoxypine with dicarboxylic acids
Acta Crystallographica Section C, 2018, 74
2021148 CIF
HKL
Paper
C11 H15 N O5P -18.9211; 10.5301; 13.7175
80.0535; 86.3313; 66.5117
1164.07Manin, Alex N.; Voronin, Alexander P.; Drozd, Ksenia V.; Churakov, Andrei V.; Perlovich, German L.
Pharmaceutical salts of emoxypine with dicarboxylic acids
Acta Crystallographica Section C, 2018, 74
2021149 CIF
HKL
Paper
C14 H21 N O5P -18.7831; 8.9442; 9.6114
77.301; 76.142; 85.677
714.9Manin, Alex N.; Voronin, Alexander P.; Drozd, Ksenia V.; Churakov, Andrei V.; Perlovich, German L.
Pharmaceutical salts of emoxypine with dicarboxylic acids
Acta Crystallographica Section C, 2018, 74
2021150 CIF
HKL
Paper
C8 H10 Cd I2 N6 O2P -17.2911; 8.1724; 12.5766
89.109; 74.2345; 87.4815
720.49Karthikeyan, Ammasai; Zeller, Matthias; Thomas Muthiah, Packianathan
Supramolecular architectures in metal(II) (Cd/Zn) halide/nitrate complexes of cytosine/5-fluorocytosine
Acta Crystallographica Section C, 2018, 74
2021151 CIF
HKL
Paper
C8 H10 Cd N8 O8P 1 21/c 112.9213; 8.5142; 13.6486
90; 104.259; 90
1455.29Karthikeyan, Ammasai; Zeller, Matthias; Thomas Muthiah, Packianathan
Supramolecular architectures in metal(II) (Cd/Zn) halide/nitrate complexes of cytosine/5-fluorocytosine
Acta Crystallographica Section C, 2018, 74
2021152 CIF
HKL
Paper
C8 H10 Br2 F2 N6 O3 ZnP -18.0586; 10.1383; 10.1842
89.6438; 68.0189; 67.7878
705.39Karthikeyan, Ammasai; Zeller, Matthias; Thomas Muthiah, Packianathan
Supramolecular architectures in metal(II) (Cd/Zn) halide/nitrate complexes of cytosine/5-fluorocytosine
Acta Crystallographica Section C, 2018, 74
2021153 CIF
HKL
Paper
C14 H9 Cl N2 O2 SP 1 21/n 115.5215; 4.1954; 20.4883
90; 93.139; 90
1332.2Joy, Monu; Anabha, E. R.; Gopi, Subash P.; Mathew, Bijo; Kumar S, Ajeesh; Mathews, Annie
Structural and optical profile of a multifunctionalized 2-pyridone derivative in a crystal engineering perspective
Acta Crystallographica Section C, 2018, 74
2021154 CIF
HKL
Paper
C13 H17.66667 N O2.33333P -18.5101; 15.023; 15.821
68.242; 80.424; 89.491
1849.3Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Cinnamamide pharmacophore for anticonvulsant activity: evidence from crystallographic studies
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021155 CIF
HKL
Paper
C13 H17 N O2P 1 21/c 15.992; 14.451; 14.346
90; 104.178; 90
1204.39Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Cinnamamide pharmacophore for anticonvulsant activity: evidence from crystallographic studies
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021156 CIF
HKL
Paper
C14 H19 N O2P 1 21/c 110.6921; 21.1761; 11.8518
90; 94.198; 90
2676.25Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Gunia-Krzyżak, Agnieszka
Cinnamamide pharmacophore for anticonvulsant activity: evidence from crystallographic studies
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021157 CIF
HKL
Paper
C14 H12 O4 SC 1 2/c 123.7755; 8.3718; 16.3235
90; 124.106; 90
2690.3Andleeb, Hina; Khan, Imtiaz; Bauzá, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio
A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and π‒π interactions in the solid-state supramolecular assembly of 2- and 4-formylphenyl arylsulfonates
Acta Crystallographica Section C, 2018, 74
2021158 CIF
HKL
Paper
C13 H9 Cl O4 SP 1 21/c 113.7066; 12.9371; 7.431
90; 91.565; 90
1317.2Andleeb, Hina; Khan, Imtiaz; Bauzá, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio
A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and π‒π interactions in the solid-state supramolecular assembly of 2- and 4-formylphenyl arylsulfonates
Acta Crystallographica Section C, 2018, 74
2021159 CIF
HKL
Paper
C13 H9 Br O4 SP -17.8282; 8.5963; 10.1139
91.249; 102.818; 95.938
659.38Andleeb, Hina; Khan, Imtiaz; Bauzá, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio
A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and π‒π interactions in the solid-state supramolecular assembly of 2- and 4-formylphenyl arylsulfonates
Acta Crystallographica Section C, 2018, 74
2021160 CIF
HKL
Paper
C13 H9 Cl O4 SP 1 21/c 110.467; 11.9547; 10.6575
90; 98.045; 90
1320.45Andleeb, Hina; Khan, Imtiaz; Bauzá, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio
A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and π‒π interactions in the solid-state supramolecular assembly of 2- and 4-formylphenyl arylsulfonates
Acta Crystallographica Section C, 2018, 74
2021161 CIF
HKL
Paper
C13 H9 Br O4 SP -16.8248; 7.2849; 15.1587
79.746; 83.57; 65.091
672.06Andleeb, Hina; Khan, Imtiaz; Bauzá, Antonio; Tahir, Muhammad Nawaz; Simpson, Jim; Hameed, Shahid; Frontera, Antonio
A comparative experimental and theoretical investigation of hydrogen-bond, halogen-bond and π‒π interactions in the solid-state supramolecular assembly of 2- and 4-formylphenyl arylsulfonates
Acta Crystallographica Section C, 2018, 74
2021162 CIF
HKL
Paper
C23 H26 O4P 1 21/c 112.251; 14.971; 10.868
90; 95.289; 90
1984.8Purushothaman, Gayathri; Thiruvenkatam, Vijay
Qualitative and quantitative analysis of intermolecular interactions in xanthenedione derivatives
Acta Crystallographica Section C, 2018, 74
2021163 CIF
HKL
Paper
C24 H27 Br O4P b c a20.6531; 9.5629; 22.4489
90; 90; 90
4433.7Purushothaman, Gayathri; Thiruvenkatam, Vijay
Qualitative and quantitative analysis of intermolecular interactions in xanthenedione derivatives
Acta Crystallographica Section C, 2018, 74
2021164 CIF
HKL
Paper
C22 H25 N O3P -19.2893; 10.0558; 22.911
83.057; 85.272; 64.888
1922.5Purushothaman, Gayathri; Thiruvenkatam, Vijay
Qualitative and quantitative analysis of intermolecular interactions in xanthenedione derivatives
Acta Crystallographica Section C, 2018, 74
2021165 CIF
HKL
Paper
C19 H16 F I N2 O4P 1 21/c 19.1241; 20.098; 10.7456
90; 110.224; 90
1849Nguyen Tien, Cong; Nguyen Van, Thin; Le Duc, Giang; Vu Quoc, Manh; Vu Quoc, Trung; Pham Chien, Thang; Nguyen Huy, Hung; Dang Thi Tuyet, Anh; Nguyen Van, Tuyen; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity testing of some 1,3,4-oxadiazoline derivatives from 2-hydroxy-5-iodobenzoic acid
Acta Crystallographica Section C, 2018, 74
2021166 CIF
HKL
Paper
C19 H16 Cl I N2 O4P 1 21/c 111.703; 22.037; 7.4073
90; 92.888; 90
1907.9Nguyen Tien, Cong; Nguyen Van, Thin; Le Duc, Giang; Vu Quoc, Manh; Vu Quoc, Trung; Pham Chien, Thang; Nguyen Huy, Hung; Dang Thi Tuyet, Anh; Nguyen Van, Tuyen; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity testing of some 1,3,4-oxadiazoline derivatives from 2-hydroxy-5-iodobenzoic acid
Acta Crystallographica Section C, 2018, 74
2021167 CIF
HKL
Paper
C19 H17 I N2 O4P 1 21/c 18.837; 20.056; 11.015
90; 110.18; 90
1832.4Nguyen Tien, Cong; Nguyen Van, Thin; Le Duc, Giang; Vu Quoc, Manh; Vu Quoc, Trung; Pham Chien, Thang; Nguyen Huy, Hung; Dang Thi Tuyet, Anh; Nguyen Van, Tuyen; Van Meervelt, Luc
Synthesis, structure and <i>in vitro</i> cytotoxicity testing of some 1,3,4-oxadiazoline derivatives from 2-hydroxy-5-iodobenzoic acid
Acta Crystallographica Section C, 2018, 74
2021168 CIF
HKL
Paper
C15 H24 N O4P 1 21/n 111.5982; 8.8651; 15.2964
90; 103.581; 90
1528.79Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Waszkielewicz, Anna M.
Supramolecular architectures of succinates of 1-hydroxypropan-2-aminium derivatives
Acta Crystallographica Section C, 2018, 74
2021169 CIF
HKL
Paper
C30 H48 N2 O8P 1 21 111.1942; 8.6142; 31.6661
90; 93.082; 90
3049.12Żesławska, Ewa; Nitek, Wojciech; Marona, Henryk; Waszkielewicz, Anna M.
Supramolecular architectures of succinates of 1-hydroxypropan-2-aminium derivatives
Acta Crystallographica Section C, 2018, 74
2021170 CIF
HKL
Paper
C24 H26 Cl F6 N2 O4 P RuP 1 21/c 17.5508; 23.0248; 15.8985
90; 102.081; 90
2702.83Traven, Katja; Turel, Iztok; Koziskova, Julia; Bučinský, Lukáč; Kožíšek, Jozef
Concomitant polymorphism in an organometallic ruthenium(II) complex with an <i>N</i>,<i>N</i>'-donor ligand
Acta Crystallographica Section C, 2018, 74, 683-689
2021171 CIF
HKL
Paper
C24 H26 Cl F6 N2 O4 P RuP 1 21/n 111.4706; 16.97; 13.9242
90; 99.55; 90
2672.87Traven, Katja; Turel, Iztok; Koziskova, Julia; Bučinský, Lukáč; Kožíšek, Jozef
Concomitant polymorphism in an organometallic ruthenium(II) complex with an <i>N</i>,<i>N</i>'-donor ligand
Acta Crystallographica Section C, 2018, 74, 683-689
2021172 CIF
HKL
Paper
C20 H26 O6P 21 21 216.6712; 11.9999; 22.2073
90; 90; 90
1777.78Brito, Maria V.; Marques, Ricardo A.; Mattos, Marcos C.; Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Oliveira, Maria C. F.; Martins, Felipe T.
Semisynthesis and absolute configuration of a novel rearranged 19,20-δ-lactone (9βH)-pimarane diterpene
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021173 CIF
HKL
Paper
C20 H32 O7P 21 21 211.7555; 20.224; 8.0385
90; 90; 90
1911.1Brito, Maria V.; Marques, Ricardo A.; Mattos, Marcos C.; Alvarenga, Meiry E.; Valdo, Ana Karoline S. M.; Oliveira, Maria C. F.; Martins, Felipe T.
Semisynthesis and absolute configuration of a novel rearranged 19,20-δ-lactone (9βH)-pimarane diterpene
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021174 CIF
HKL
Paper
C24 H16 Cd N2 O8C 1 2/c 110.392; 12.459; 15.726
90; 94.25; 90
2030.5Zhou, Qian-Kun; Wang, Lin; Liu, Dong
Construction of a three-dimensional supramolecular framework based on an anionic cadmium(II) coordination network and protonated dipyridine organic cations
Acta Crystallographica Section C, 2018, 74
2021175 CIF
HKL
Paper
C21 H17 Cd N3 O4P -19.1432; 10.439; 10.872
73.04; 83.23; 78.38
970.3Wang, Lin; Zhou, Qian-Kun; Xu, Yun; Li, Ni-Ya
Substituent effects of two isophthalate derivatives on the construction of cadmium coordination polymers incorporating a dipyridyl ligand
Acta Crystallographica Section C, 2018, 74
2021176 CIF
HKL
Paper
C20 H15 Cd N3 O5P b c a12.387; 14.684; 20.016
90; 90; 90
3640.7Wang, Lin; Zhou, Qian-Kun; Xu, Yun; Li, Ni-Ya
Substituent effects of two isophthalate derivatives on the construction of cadmium coordination polymers incorporating a dipyridyl ligand
Acta Crystallographica Section C, 2018, 74
2021178 CIF
Paper
C9 H7 Br0.43 Cl0.57 O2P 1 21/a 112.3957; 4.9381; 14.2102
90; 94.871; 90
866.68Khoj, Manal A.; Hughes, Colan E.; Harris, Kenneth D. M.; Kariuki, Benson M.
Polymorphic phase transformations of 3-chloro-<i>trans</i>-cinnamic acid and its solid solution with 3-bromo-<i>trans</i>-cinnamic acid
Acta Crystallographica Section C, 2018, 74
2021179 CIF
HKL
Paper
C9 H7 Br0.49 Cl0.51 O2C 1 2/c 119.054; 3.9451; 24.661
90; 111.81; 90
1721.1Khoj, Manal A.; Hughes, Colan E.; Harris, Kenneth D. M.; Kariuki, Benson M.
Polymorphic phase transformations of 3-chloro-<i>trans</i>-cinnamic acid and its solid solution with 3-bromo-<i>trans</i>-cinnamic acid
Acta Crystallographica Section C, 2018, 74
2021180 CIF
HKL
Paper
C20 H20 N3 O3 P SP 1 21 116.4417; 5.1623; 23.7712
90; 107.43; 90
1924.99Pietrzak, Anna; Modranka, Jakub; Wojciechowski, Jakub; Janecki, Tomasz; Wolf, Wojciech M.
Supramolecular architecture in azaheterocyclic phosphonates. III. Structures of an ethyl phosphonamidate and an ethyl phosphonate
Acta Crystallographica Section C, 2018, 74
2021181 CIF
HKL
Paper
C18 H25 N2 O4 P SP -19.6275; 10.0903; 11.8585
65.779; 67.462; 74.329
961.59Pietrzak, Anna; Modranka, Jakub; Wojciechowski, Jakub; Janecki, Tomasz; Wolf, Wojciech M.
Supramolecular architecture in azaheterocyclic phosphonates. III. Structures of an ethyl phosphonamidate and an ethyl phosphonate
Acta Crystallographica Section C, 2018, 74
2021182 CIF
HKL
Paper
C18 H30 Cu F5 N6 Nb OP 1 21/c 19.3311; 13.2097; 19.9741
90; 93.275; 90
2458.01Sharko, Anastasiya V.; Erhart, Oliver; Krautscheid, Harald; Domasevitch, Kostiantyn V.
Making an order: the concerted alignment of [<i>M</i>OF~5~]^2{-^} (<i>M</i> = Nb and Ta) dipolar anions in one-dimensional coordination chains sustained by tris(3,4,5-trimethyl-1<i>H</i>-pyrazole)copper(II)
Acta Crystallographica Section C, 2018, 74
2021183 CIF
HKL
Paper
C18 H30 Cu F5 N6 O TaP 1 21/c 19.3367; 13.1541; 20.0036
90; 93.232; 90
2452.85Sharko, Anastasiya V.; Erhart, Oliver; Krautscheid, Harald; Domasevitch, Kostiantyn V.
Making an order: the concerted alignment of [<i>M</i>OF~5~]^2{-^} (<i>M</i> = Nb and Ta) dipolar anions in one-dimensional coordination chains sustained by tris(3,4,5-trimethyl-1<i>H</i>-pyrazole)copper(II)
Acta Crystallographica Section C, 2018, 74
2021184 CIF
HKL
Paper
C45.042 H52.17 Cl2 F2 N8 O7P -17.337; 10.991; 27.078
98.241; 91.151; 91.244
2159.9Angira, Deekshi; Shaik, Althaf; Kirubakaran, Sivapriya; Thiruvenkatam, Vijay
Exploring a solvated dimer of Gefitinib: a quantitative analysis
Acta Crystallographica Section C, 2018, 74
2021185 CIF
HKL
Paper
Cs H12 Mn O10 PP 63 m c6.9809; 6.9809; 12.027
90; 90; 120
507.59Kiriukhina, Galina V.; Yakubovich, Olga V.; Kochetkova, Ekaterina M.; Dimitrova, Olga V.; Volkov, Anatoliy S.
A first Mn member in the struvite morphotropic series, CsMn(H~2~O)~6~(PO~4~): hydrothermal synthesis, crystal structure and interconnections within the family of related phosphates
Acta Crystallographica Section C, 2018, 74
2021186 CIF
HKL
Paper
C18 H20 Br3 Cd N5 O9P 1 21/c 17.9226; 19.1965; 17.2011
90; 102.46; 90
2554.4Zhang, Chong; Zhang, Kou-Lin
Synthesis and characterization of two one-dimensional Cd^II^ coordination polymers (CPs) with 5-amino-2,4,6-tribromoisophthalic acid and flexible N-donor bipyridyl ligands
Acta Crystallographica Section C, 2018, 74
2021187 CIF
HKL
Paper
C21 H30 Br3 Cd N5 O12P 1 21/c 117.7463; 8.6866; 21.9891
90; 116.41; 90
3036Zhang, Chong; Zhang, Kou-Lin
Synthesis and characterization of two one-dimensional Cd^II^ coordination polymers (CPs) with 5-amino-2,4,6-tribromoisophthalic acid and flexible N-donor bipyridyl ligands
Acta Crystallographica Section C, 2018, 74
2021188 CIF
HKL
Paper
C31 H32 Cd2 N4 O12P 1 21/n 111.2716; 26.9672; 11.3809
90; 109.986; 90
3251Li, Fenfang; Zhu, Miaoli; Lu, Liping
A two-dimensional cadmium(II) coordination polymer constructed from 4-carboxy-1-(4-carboxylatobenzyl)-2-propyl-1<i>H</i>-imidazole-5-carboxylate and 1-(4-carboxylatobenzyl)-2-propyl-1<i>H</i>-imidazole-4-carboxylate ligands
Acta Crystallographica Section C, 2018, 74
2021189 CIF
HKL
Paper
C22 H17 I2 N2 O0.5 S2C 1 2/c 121.3218; 8.6006; 25.2773
90; 112.768; 90
4274.2Rudakov, Boris V.; Stash, Adam I.; Makarov, Gennady I.; Matveychuk, Yury V.; Zherebtsov, Dmitry A.; Bartashevich, Ekaterina V.
Why are reactions of 2- and 8-thioquinoline derivatives with iodine different?
Acta Crystallographica Section C, 2018, 74
2021190 CIF
HKL
Paper
C22 H16 I4 N2 S2P -18.409; 11.1793; 15.0322
100.233; 105.798; 100.372
1298.61Rudakov, Boris V.; Stash, Adam I.; Makarov, Gennady I.; Matveychuk, Yury V.; Zherebtsov, Dmitry A.; Bartashevich, Ekaterina V.
Why are reactions of 2- and 8-thioquinoline derivatives with iodine different?
Acta Crystallographica Section C, 2018, 74
2021191 CIF
HKL
Paper
C8 H11 K O11 S ZnP 1 21/n 16.7891; 16.7667; 11.7793
90; 90.752; 90
1340.73Silva, Flávia H.; Franco, Chris H. J.; Corrêa, Charlane C.; Diniz, Renata
Synthesis, crystal structure and topological analysis of a three-dimensional polymeric network based on zinc(II), potassium and 5-sulfobenzene-1,3-dicarboxylate (SIP)
Acta Crystallographica Section C, 2018, 74
2021192 CIF
HKL
C12 H18 N2 O7P b c n7.5583; 12.7016; 15.7903
90; 90; 90
1515.9Mao, Yimin; Zavalij, Peter Y.
Two furan-2,5-dicarboxylic acid solvates crystallized from dimethylformamide and dimethyl sulfoxide
Acta Crystallographica Section C, 2018, 74, 986-990
2021193 CIF
HKL
C8 H10 O6 SP -16.3129; 6.9099; 13.0901
80.5164; 77.3664; 63.826
498.53Mao, Yimin; Zavalij, Peter Y.
Two furan-2,5-dicarboxylic acid solvates crystallized from dimethylformamide and dimethyl sulfoxide
Acta Crystallographica Section C, 2018, 74, 986-990
2021194 CIF
HKL
Paper
C13 H22 N O2 P SP 18.4954; 8.679; 10.7105
100.366; 100.314; 90.093
763.79Torabi Farkhani, Elham; Pourayoubi, Mehrdad; Izadyar, Mohammad; Andreev, Pavel V.; Shchegravina, Ekaterina S.
Evaluation of N—H···S and N—H···π interactions in <i>O</i>,<i>O</i>'-diethyl <i>N</i>-(2,4,6-trimethylphenyl)thiophosphate: a combination of X-ray crystallographic and theoretical studies
Acta Crystallographica Section C, 2018, 74, 847-855
2021195 CIF
HKL
Paper
C20 H12 Cl F N3 O4 ReP -17.2479; 8.1177; 16.9716
81.374; 86.946; 81.339
975.51Mark-Lee, Wun Fui; Chong, Yan Yi; Kassim, Mohammad B.
Supramolecular structures of rhenium(I) complexes mediated by ligand planarity <i>via</i> the interplay of substituents
Acta Crystallographica Section C, 2018, 74
2021196 CIF
HKL
Paper
C23 H18 Cl N4 O7 ReP -17.9828; 12.0719; 14.456
104.093; 99.708; 104.184
1270.78Mark-Lee, Wun Fui; Chong, Yan Yi; Kassim, Mohammad B.
Supramolecular structures of rhenium(I) complexes mediated by ligand planarity <i>via</i> the interplay of substituents
Acta Crystallographica Section C, 2018, 74
2021197 CIF
HKL
Paper
C11 H11 Br Cl N3 O2 SP -17.5237; 7.5739; 12.5089
79.629; 79.596; 75.895
673Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021198 CIF
HKL
Paper
C11 H11 Cl2 N3 O2 SP -17.2182; 7.6364; 12.7516
90.707; 102.629; 105.338
659.61Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021199 CIF
HKL
Paper
C13 H12 Cl3 N3 O2P -17.3015; 7.506; 14.9665
92.539; 98.522; 113.657
738.12Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021200 CIF
Paper
C13 H15 Cl N4 O2P 1 21/n 18.0965; 7.2427; 24.0738
90; 90.831; 90
1411.55Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021201 CIF
HKL
Paper
C12 H14 Cl N3 O2 SP 1 21/c 18.273; 12.746; 13.32
90; 102.39; 90
1371.9Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021202 CIF
HKL
Paper
C13 H14 Cl N3 O2P 1 21/c 110.1421; 10.4218; 13.2681
90; 107.804; 90
1335.26Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021203 CIF
HKL
Paper
C14 H16 Cl N3 O2P 21 21 217.3992; 13.9842; 26.9897
90; 90; 90
2792.68Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021204 CIF
HKL
Paper
C14 H16 Cl N3 O2P b c n8.4524; 13.5387; 24.9813
90; 90; 90
2858.72Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021205 CIF
HKL
Paper
C14 H16 Cl N3 O2P 1 21/c 18.0223; 13.6901; 13.3346
90; 101.557; 90
1434.8Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021206 CIF
HKL
Paper
C13 H15 Cl N4 O2P 1 21/c 17.8899; 13.2361; 13.3212
90; 101.254; 90
1364.4Rajam, Ammaiyappan; Muthiah, Packianathan Thomas; Butcher, Raymond John; Jasinski, Jerry P.; Wikaira, Jan
Design of two series of 1:1 cocrystals involving 4-amino-5-chloro-2,6-dimethylpyrimidine and carboxylic acids
Acta Crystallographica Section C, 2018, 74
2021208 CIF
HKL
Paper
C54 H31.42 Co3 N4 O14.71C 1 2/c 118.889; 20.431; 13.36
90; 110.73; 90
4822Li, Shao-Dong; Lu, Li-Ping; Zhu, Miao-Li
A thermally stable three-dimensional cobalt(II) coordination polymer based on the V-shaped ligand 4-(4-carboxyphenoxy)isophthalate
Acta Crystallographica Section C, 2018, 74
2021209 CIF
HKL
Paper
C38 H66 N2 O7 SP -19.2201; 9.3675; 24.2874
96.303; 97.731; 97.049
2045.83Wu, Xiangxiang; Zeng, Huahui; Yang, Yunxia
Composite host lattices of 4,4'-sulfonyldibenzoate water/boric acid in two tetrapropylammonium inclusion compounds
Acta Crystallographica Section C, 2018, 74
2021210 CIF
HKL
Paper
C38 H70 B2 N2 O12 SP 1 21/c 125.184; 11.2494; 15.9615
90; 93.796; 90
4512.1Wu, Xiangxiang; Zeng, Huahui; Yang, Yunxia
Composite host lattices of 4,4'-sulfonyldibenzoate water/boric acid in two tetrapropylammonium inclusion compounds
Acta Crystallographica Section C, 2018, 74
2021211 CIF
HKL
Paper
C16 H18 N4 O4P -16.7032; 8.1646; 15.1177
81.099; 79.555; 67.488
748.34Badour, Alec R.; Arnett-Butscher, Corey J.; Mohanty, Dillip K.; Squattrito, Philip J.; Lambright, Kelly J.; Kirschbaum, Kristin
Models for potential dendritic nitric oxide-donors: crystal structures of two 2-nitroanilino precursors and nitric oxide-release behavior of the nitrosated derivatives
Acta Crystallographica Section C, 2018, 74
2021212 CIF
HKL
Paper
C24 H27 N7 O6P b c a7.5749; 13.4138; 46.3793
90; 90; 90
4712.5Badour, Alec R.; Arnett-Butscher, Corey J.; Mohanty, Dillip K.; Squattrito, Philip J.; Lambright, Kelly J.; Kirschbaum, Kristin
Models for potential dendritic nitric oxide-donors: crystal structures of two 2-nitroanilino precursors and nitric oxide-release behavior of the nitrosated derivatives
Acta Crystallographica Section C, 2018, 74
2021213 CIF
HKL
Paper
Na13 O36 P9 Sr2 Ta2P 63/m9.0062; 9.0062; 23.1525
90; 90; 120
1626.34Zhao, Ji; Zhao, Dan; Xue, Ya-Li; Zhong, Qiu; Zhang, Shi-Rui; Liu, Bao-Zhong
Novel tantalum phosphate Na~13~Sr~2~Ta~2~(PO~4~)~9~: synthesis, crystal structure, DFT calculations and Dy^3+^-activated fluorescence performance
Acta Crystallographica Section C, 2018, 74
2021214 CIF
HKL
Paper
C28 H20 N2 O4 ZnP 1 21/c 111.16; 12.917; 18.551
90; 119.79; 90
2320.8Zhou, Qian-Kun; Wang, Lin; Xu, Yun; Li, Ni-Ya
Construction and photoluminescence properties of a three-dimensional Zn^II^ coordination network based on naphthalene-1,4-dicarboxylic acid and 1,6-bis(pyridin-3-yl)-1,3,5-hexatriene
Acta Crystallographica Section C, 2018, 74, 1053-1057
2021215 CIF
HKL
Paper
C8 H14 N2 O2P 43 21 26.9584; 6.9584; 18.8979
90; 90; 90
915.02García-Reyes, Fernando; Fantoni, Adolfo C.; Barón, Máximo; Romano, Rosana M.; Punte, Graciela M.; Echeverría, Gustavo A.
Role of weak C—H···O and strong N—H···O intermolecular interactions on the high-symmetry molecular packing of <i>trans</i>-cyclohexane-1,4-dicarboxamide
Acta Crystallographica Section C, 2018, 74, 1068-1078
2021216 CIF
HKL
Paper
C30 H49 As2 Mo6 N5 O30P 1 21/c 114.1301; 15.4385; 23.1563
90; 98.9698; 90
4989.71Harchani, Ali; Trzybiński, Damian; Pawledzio, Sylwia; Woźniak, Krzysztof; Haddad, Amor
The new heteropolyoxometalate compound (C~6~H~8~N)~5~[HAs~2~Mo~6~O~26~(H~2~O)]·3H~2~O: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section C, 2018, 74, 1088-1093
2021217 CIF
HKL
Paper
C18 H17 N3 O4 SP 1 21/c 120.344; 9.6384; 9.443
90; 101.06; 90
1817.2Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021218 CIF
HKL
Paper
C19 H18 Br N3 O5 SP 1 21/c 113.6043; 12.2399; 12.9506
90; 103.854; 90
2093.7Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021219 CIF
HKL
Paper
C14 H12 Br N O3P 1 21/c 113.297; 15.095; 6.4166
90; 91.329; 90
1287.6Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021220 CIF
HKL
Paper
C15 H14 Br N O3P -16.4158; 7.3886; 15.2636
87.081; 87.488; 77.948
706.28Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021221 CIF
HKL
Paper
C15 H15 N O3P c a 2123.689; 7.6951; 7.3488
90; 90; 90
1339.6Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021222 CIF
HKL
Paper
C22 H18 F N O2 SP 1 21/n 19.5004; 14.2911; 13.6497
90; 97.524; 90
1837.3Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021223 CIF
HKL
Paper
C22 H19 N O2 SP 1 21/n 19.26395; 14.2886; 13.6476
90; 96.7581; 90
1793.97Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021224 CIF
HKL
Paper
C13 H11 N O2P -19.0479; 10.1564; 12.3659
69.677; 89.94; 77.004
1034.62Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
Acta Crystallographica Section C, 2018, 74, 1094-1104
2021226 CIF
HKL
Paper
C8 H7 Cd N2 O6P 1 21/m 16.934; 15.213; 9.6882
90; 105.496; 90
984.8Liu, Yan-Ju; Cheng, Di; Li, Ya-Xue; Zhang, Jun-Di; Yang, Huai-Xia
A new one-dimensional Cd^II^ coordination polymer incorporating 2,2'-(1,2-phenylene)bis(1<i>H</i>-imidazole-4,5-dicarboxylate)
Acta Crystallographica Section C, 2018, 74, 1128-1132
2021227 CIF
HKL
Paper
C15 H13 N O6 Re2 S3P -19.446; 14.885; 15.91
104.676; 106.554; 104.43
1945.8Nkoe, Pheello I.; Visser, Hendrik G.; Swart, Chantel; Brink, Alice; Schutte-Smith, Marietjie
Synthesis of Re^I^ tricarbonyl complexes with various sulfur- and oxygen-donating ligands: crystal structures of two Re^I^ dinuclear structures bridged by S atoms
Acta Crystallographica Section C, 2018, 74, 1116-1122
2021228 CIF
HKL
Paper
C35 H41 N O9 Re2 S3C 1 c 112.712; 17.105; 18.144
90; 91.47; 90
3943.9Nkoe, Pheello I.; Visser, Hendrik G.; Swart, Chantel; Brink, Alice; Schutte-Smith, Marietjie
Synthesis of Re^I^ tricarbonyl complexes with various sulfur- and oxygen-donating ligands: crystal structures of two Re^I^ dinuclear structures bridged by S atoms
Acta Crystallographica Section C, 2018, 74, 1116-1122
2021229 CIF
HKL
C42 H36 La N3 O6P -18.0705; 12.588; 19.096
79.209; 86.351; 73.384
1826Roitershtein, Dmitrii M.; Minashina, Kseniya I.; Minyaev, Mikhail E.; Ananyev, Ivan V.; Lyssenko, Konstantin A.; Tavtorkin, Alexander N.; Nifant'ev, Ilya E.
Different coordination modes of <i>trans</i>-2-{[(2-methoxyphenyl)imino]methyl}phenoxide in rare-earth complexes: influence of the metal cation radius and the number of ligands on steric congestion and ligand coordination modes
Acta Crystallographica Section C, 2018, 74, 1105-1115
2021230 CIF
HKL
C50 H52 N3 Nd O8P -111.1951; 14.8767; 15.1894
69.758; 74.797; 69.502
2194.4Roitershtein, Dmitrii M.; Minashina, Kseniya I.; Minyaev, Mikhail E.; Ananyev, Ivan V.; Lyssenko, Konstantin A.; Tavtorkin, Alexander N.; Nifant'ev, Ilya E.
Different coordination modes of <i>trans</i>-2-{[(2-methoxyphenyl)imino]methyl}phenoxide in rare-earth complexes: influence of the metal cation radius and the number of ligands on steric congestion and ligand coordination modes
Acta Crystallographica Section C, 2018, 74, 1105-1115
2021231 CIF
HKL
C42 H36 N3 O6 YP -112.1048; 17.5475; 18.7959
114.881; 91.885; 99.171
3553.2Roitershtein, Dmitrii M.; Minashina, Kseniya I.; Minyaev, Mikhail E.; Ananyev, Ivan V.; Lyssenko, Konstantin A.; Tavtorkin, Alexander N.; Nifant'ev, Ilya E.
Different coordination modes of <i>trans</i>-2-{[(2-methoxyphenyl)imino]methyl}phenoxide in rare-earth complexes: influence of the metal cation radius and the number of ligands on steric congestion and ligand coordination modes
Acta Crystallographica Section C, 2018, 74, 1105-1115
2021232 CIF
HKL
C49 H55 Cl2 N3 O10 Y2P 1 21/c 118.7839; 13.3371; 20.1422
90; 107.107; 90
4822.8Roitershtein, Dmitrii M.; Minashina, Kseniya I.; Minyaev, Mikhail E.; Ananyev, Ivan V.; Lyssenko, Konstantin A.; Tavtorkin, Alexander N.; Nifant'ev, Ilya E.
Different coordination modes of <i>trans</i>-2-{[(2-methoxyphenyl)imino]methyl}phenoxide in rare-earth complexes: influence of the metal cation radius and the number of ligands on steric congestion and ligand coordination modes
Acta Crystallographica Section C, 2018, 74, 1105-1115
2021233 CIF
HKL
C58 H50 Cl6 N4 Na O8 YP -114.542; 15.366; 15.487
108.34; 106.19; 108.77
2818.3Roitershtein, Dmitrii M.; Minashina, Kseniya I.; Minyaev, Mikhail E.; Ananyev, Ivan V.; Lyssenko, Konstantin A.; Tavtorkin, Alexander N.; Nifant'ev, Ilya E.
Different coordination modes of <i>trans</i>-2-{[(2-methoxyphenyl)imino]methyl}phenoxide in rare-earth complexes: influence of the metal cation radius and the number of ligands on steric congestion and ligand coordination modes
Acta Crystallographica Section C, 2018, 74, 1105-1115
2021234 CIF
HKL
Paper
C34 H26 Co N4 O5P 1 21/n 17.844; 20.558; 17.168
90; 90.93; 90
2768Chen, Ning-Ning; Ni, Jian-Ling; Wang, Jun
A new two-dimensional Co^II^ coordination polymer based on bis[4-(2-methyl-1<i>H</i>-imidazol-1-yl)phenyl] ether and biphenyl-4,4'-diyldicarboxylic acid: synthesis, crystal structure and photocatalytic degradation activity
Acta Crystallographica Section C, 2018, 74, 1123-1127
2021235 CIF
HKL
Paper
C13 H9 N O4 ZnP 1 21/c 112.8902; 21.9049; 8.8786
90; 109.699; 90
2360.2Luo, Fuming; Tang, Guodong; Zhang, Jinfang
A new Zn^II^ coordination polymer based on 4-(pyridin-4-yl)benzoic and formic acids: <i>in-situ</i> synthesis, crystal structure and luminescence properties
Acta Crystallographica Section C, 2018, 74, 1133-1137
2021236 CIF
HKL
Paper
C10 H20 N5 Na2 O12 PP 1 21 15.5965; 10.7222; 15.71
90; 98.796; 90
931.6Tsubonoya, Masaaki; Murofushi, Akitaka; Yamamura, Shigefumi; Sugawara, Yoko
Crystal structure and sequential dehydration transitions of disodium guanosine 5'-monophosphate tetrahydrate
Acta Crystallographica Section C, 2018, 74, 1153-1159
2021237 CIF
HKL
Paper
Ge2 H7 O24 P6 Rb3R -3 :H14.594; 14.594; 8.5522
90; 90; 120
1577.46Song, Jun-Ling; Lu, Wen-Xiu; Guo, Tian-Shuo; Zhou, Yu-Hua
Syntheses, crystal structures and optical properties of two one-dimensional germanophosphates: HRb~3~Ge~2~(HPO~4~)~6~ and CsGe(HPO~4~)~2~(OH)
Acta Crystallographica Section C, 2018, 74, 1146-1152
2021238 CIF
HKL
Paper
Cs Ge H3 O9 P2P -18.3453; 9.642; 9.739
89.762; 83.744; 88.946
778.9Song, Jun-Ling; Lu, Wen-Xiu; Guo, Tian-Shuo; Zhou, Yu-Hua
Syntheses, crystal structures and optical properties of two one-dimensional germanophosphates: HRb~3~Ge~2~(HPO~4~)~6~ and CsGe(HPO~4~)~2~(OH)
Acta Crystallographica Section C, 2018, 74, 1146-1152
2021239 CIF
HKL
Paper
C21 H19 Cl N2 O2 SP -17.8332; 10.401; 12.166
76.05; 84.86; 79.63
945.1Stolarczyk, Marcin; Bryndal, Iwona; Matera-Witkiewicz, Agnieszka; Lis, Tadeusz; Królewska-Golińska, Karolina; Cieślak, Marcin; Kaźmierczak-Barańska, Julia; Cieplik, Jerzy
Synthesis, crystal structure and cytotoxic activity of novel 5-methyl-4-thiopyrimidine derivatives
Acta Crystallographica Section C, 2018, 74, 1138-1145
2021240 CIF
HKL
Paper
C19 H17 Cl N2 O SP 1 21/c 14.6074; 22.882; 31.816
90; 92.41; 90
3351.3Stolarczyk, Marcin; Bryndal, Iwona; Matera-Witkiewicz, Agnieszka; Lis, Tadeusz; Królewska-Golińska, Karolina; Cieślak, Marcin; Kaźmierczak-Barańska, Julia; Cieplik, Jerzy
Synthesis, crystal structure and cytotoxic activity of novel 5-methyl-4-thiopyrimidine derivatives
Acta Crystallographica Section C, 2018, 74, 1138-1145
2021241 CIF
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C19 H17 Cl N2 SP 1 21/c 114.4729; 11.4849; 10.3302
90; 104.605; 90
1661.6Stolarczyk, Marcin; Bryndal, Iwona; Matera-Witkiewicz, Agnieszka; Lis, Tadeusz; Królewska-Golińska, Karolina; Cieślak, Marcin; Kaźmierczak-Barańska, Julia; Cieplik, Jerzy
Synthesis, crystal structure and cytotoxic activity of novel 5-methyl-4-thiopyrimidine derivatives
Acta Crystallographica Section C, 2018, 74, 1138-1145
2021242 CIF
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Paper
C29 H23 Cl2 F6 N O3 SP 1 21/n 18.6718; 23.5083; 14.3939
90; 102.962; 90
2859.6Li, Ning; Bai, Xianyong; Zhang, Lianshuang; Hou, Yun
Synthesis, crystal structures and anti-inflammatory activity of four 3,5-bis(arylidene)-<i>N</i>-benzenesulfonyl-4-piperidone derivatives
Acta Crystallographica Section C, 2018, 74, 1171-1179
2021243 CIF
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C27 H18 F7 N O3 SP -18.5664; 10.0932; 14.3871
90.59; 98.592; 97.309
1219.44Li, Ning; Bai, Xianyong; Zhang, Lianshuang; Hou, Yun
Synthesis, crystal structures and anti-inflammatory activity of four 3,5-bis(arylidene)-<i>N</i>-benzenesulfonyl-4-piperidone derivatives
Acta Crystallographica Section C, 2018, 74, 1171-1179
2021244 CIF
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C27 H18 F6 N2 O5 SP -17.4346; 11.6714; 14.6479
90.825; 96.884; 98.971
1245.7Li, Ning; Bai, Xianyong; Zhang, Lianshuang; Hou, Yun
Synthesis, crystal structures and anti-inflammatory activity of four 3,5-bis(arylidene)-<i>N</i>-benzenesulfonyl-4-piperidone derivatives
Acta Crystallographica Section C, 2018, 74, 1171-1179
2021245 CIF
HKL
Paper
C29 H20 Cl2 F6 N2 O3 SP -19.7338; 12.4558; 12.6397
70.586; 88.379; 81.726
1429.97Li, Ning; Bai, Xianyong; Zhang, Lianshuang; Hou, Yun
Synthesis, crystal structures and anti-inflammatory activity of four 3,5-bis(arylidene)-<i>N</i>-benzenesulfonyl-4-piperidone derivatives
Acta Crystallographica Section C, 2018, 74, 1171-1179
2021247 CIF
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Paper
C72 H122 O36 P6 Ti7C 1 2/c 123.073; 12.9877; 34.994
90; 105.158; 90
10122Gao, Mei-Yan; Liu, Xiao-Xue; Fang, Wei-Hui; Zhang, Lei; Zhang, Jian
Synthesis and structural characterization of a dumbbell-like phenylphosphonate-stabilized Ti~7~‒oxide cluster
Acta Crystallographica Section C, 2018, 74
2021248 CIF
Paper
C88 H147 Mn Mo6 N6 O24P 1 21/c 115.2871; 25.654; 24.9018
90; 90.321; 90
9765.7Fura, Gizaw D.; Long, Yong; Yan, Jun; Chen, Wei; Lin, Chang-Gen; Song, Yu-Fei
Synthesis, structural characterization and fluorescence enhancement of chromophore-modified polyoxometalates
Acta Crystallographica Section C, 2018, 74
2021249 CIF
Paper
C88 H154 Mn Mo6 N5 O25C 1 2/c 137.884; 13.9437; 25.336
90; 128.39; 90
10490Fura, Gizaw D.; Long, Yong; Yan, Jun; Chen, Wei; Lin, Chang-Gen; Song, Yu-Fei
Synthesis, structural characterization and fluorescence enhancement of chromophore-modified polyoxometalates
Acta Crystallographica Section C, 2018, 74
2021250 CIF
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C82 H150 Mn Mo6 N5 O25C 1 2/c 137.431; 13.1303; 25.288
90; 127.639; 90
9842Fura, Gizaw D.; Long, Yong; Yan, Jun; Chen, Wei; Lin, Chang-Gen; Song, Yu-Fei
Synthesis, structural characterization and fluorescence enhancement of chromophore-modified polyoxometalates
Acta Crystallographica Section C, 2018, 74
2021251 CIF
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Paper
C96 H120 Cl6 N12 O102 V30F m -3 m29.7184; 29.7184; 29.7184
90; 90; 90
26247Gong, Ya-Ru; Su, Zhong-Min; Wang, Xin-Long
A polyoxometalate-based metal‒organic polyhedron constructed from a {V5O9Cl} building unit with rhombicuboctahedral geometry
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021252 CIF
Paper
C28 H64 Bi Cu2 N12 O65.5 W18P 1 21/n 116.0955; 12.9013; 19.2456
90; 101.664; 90
3913.9He, Shuai; Xin, Ying; Li, Jiansheng; Zhu, Zaiming; Zhao, Peng; You, Wansheng
A novel two-dimensional layered Cu^2+^ complex based on Dawson-like [H~3~BiW~18~O~60~]^6{-^}: synthesis, structure and magnetic properties
Acta Crystallographica Section C, 2018, 74
2021253 CIF
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Paper
Cu3 H44 Na4 O68 W12P -110.6516; 12.7532; 13.073
113.771; 90.443; 112.502
1473.65Gumerova, Nadiia I.; Dobrov, Anatolie; Roller, Alexander; Rompel, Annette
Iron(II) and copper(II) paratungstates B: a single-crystal X-ray diffraction study
Acta Crystallographica Section C, 2018, 74
2021254 CIF
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Paper
Fe2.5 H62 Na5 O78 W12P -112.3758; 14.7752; 18.8919
92.9341; 100.694; 94.1698
3378.1Gumerova, Nadiia I.; Dobrov, Anatolie; Roller, Alexander; Rompel, Annette
Iron(II) and copper(II) paratungstates B: a single-crystal X-ray diffraction study
Acta Crystallographica Section C, 2018, 74
2021255 CIF
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Paper
C54 H80 Cr6 N8 O69 Si W12C 1 2/c 132.303; 25.546; 13.561
90; 110.885; 90
10455Miyazawa, Satoru; Hosono, Reina; Osuga, Ryota; Kondo, Junko Nomura; Uchida, Sayaka
Effect of the ammonium ion on proton conduction in porous ionic crystals based on Keggin-type silicododecatungstate
Acta Crystallographica Section C, 2018, 74
2021256 CIF
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Paper
Ge2 H80 K4 Na16 O181 P2 W38 Zr4P 1 2/n 122.5605; 11.4578; 32.7134
90; 95.172; 90
8421.8Zhang, Zhong; Wang, Yue-Lin; Yang, Guo-Yu
An unprecedented Zr-containing polyoxometalate tetramer with mixed trilacunary/dilacunary Keggin-type polyoxotungstate units
Acta Crystallographica Section C, 2018, 74
2021257 CIF
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Paper
C41 H103 N9 O34 V12P n a 2126.3672; 13.0801; 20.6502
90; 90; 90
7122Kuwajima, Sho; Arai, Yuta; Kitajima, Hiromasa; Kikukawa, Yuji; Hayashi, Yoshihito
Synthesis and structural characterization of tube-type tetradecavanadates
Acta Crystallographica Section C, 2018, 74
2021258 CIF
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Paper
C12 H64 N10 O44 S6 V14C 1 2/c 119.272; 24.785; 14.552
90; 116.387; 90
6227Kuwajima, Sho; Arai, Yuta; Kitajima, Hiromasa; Kikukawa, Yuji; Hayashi, Yoshihito
Synthesis and structural characterization of tube-type tetradecavanadates
Acta Crystallographica Section C, 2018, 74
2021259 CIF
HKL
Paper
C13 H64 N8 O45 S6 V14C 1 2/c 119.352; 24.753; 14.561
90; 116.537; 90
6240Kuwajima, Sho; Arai, Yuta; Kitajima, Hiromasa; Kikukawa, Yuji; Hayashi, Yoshihito
Synthesis and structural characterization of tube-type tetradecavanadates
Acta Crystallographica Section C, 2018, 74
2021260 CIF
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Paper
C12 H64 N8 O47 S6 V14C 1 2/c 119.3923; 24.9031; 14.5785
90; 116.374; 90
6307.6Kuwajima, Sho; Arai, Yuta; Kitajima, Hiromasa; Kikukawa, Yuji; Hayashi, Yoshihito
Synthesis and structural characterization of tube-type tetradecavanadates
Acta Crystallographica Section C, 2018, 74
2021261 CIF
Paper
C42 H18 Dy3 N6 Na O73.5 Si W12R 320.3334; 20.3334; 18.7836
90; 90; 120
6725.58Derakhshanrad, Shadi; Mirzaei, Masoud; Najafi, Atefeh; Ritchie, Chris; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.
Surface-grafted lanthanoid complexes of the tungstosilicate polyanion [SiW~12~O~40~]^4{-^}: a synthetic, structural and computational investigation
Acta Crystallographica Section C, 2018, 74
2021262 CIF
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C21 H53 N3 Na O80 Pr3 Si W12R 318.119; 18.119; 21.078
90; 90; 120
5992.8Derakhshanrad, Shadi; Mirzaei, Masoud; Najafi, Atefeh; Ritchie, Chris; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.
Surface-grafted lanthanoid complexes of the tungstosilicate polyanion [SiW~12~O~40~]^4{-^}: a synthetic, structural and computational investigation
Acta Crystallographica Section C, 2018, 74
2021263 CIF
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Paper
C36 H25 Eu N6 O14P 6515.1172; 15.1172; 28.034
90; 90; 120
5548.3Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021264 CIF
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Paper
C36 H25 Eu N6 O14P 6114.981; 14.981; 27.897
90; 90; 120
5422Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021265 CIF
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Paper
C36 H25 Gd N6 O14P 6514.9855; 14.9855; 27.949
90; 90; 120
5435.5Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021266 CIF
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Paper
C36 H25 Gd N6 O14P 6114.9709; 14.9709; 27.952
90; 90; 120
5425.5Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021267 CIF
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Paper
C36 H25 Dy N6 O14P 6514.905; 14.905; 27.912
90; 90; 120
5370Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021268 CIF
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Paper
C36 H25 Dy N6 O14P 6114.9066; 14.9066; 27.948
90; 90; 120
5378.2Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021269 CIF
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Paper
C36 H25 N6 O14 TbP 6514.9349; 14.9349; 27.969
90; 90; 120
5402.7Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021270 CIF
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C36 H25 N6 O14 TbP 6114.962; 14.962; 27.974
90; 90; 120
5423.3Qin, Tao; Feng, Zhe; Yang, Jie; Shen, Xuan; Zhu, Dunru
Unprecedented three-dimensional hydrogen-bonded hex topological chiral lanthanide‒organic frameworks built from an achiral ligand
Acta Crystallographica Section C, 2018, 74
2021271 CIF
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Paper
C20 H28 Mo8 N8 O26P -110.4179; 10.5225; 10.5988
65.356; 69.658; 77.922
987.36Duan, Fengxue; Liu, Xiaoting; Xu, Wei; Tao, Yanchun; Li, Bao; Wu, Lixin
Supramolecular interaction-induced assemblies of polyanions and 2-aminopyridinium in two polyoxometalate-based hybrids
Acta Crystallographica Section C, 2018, 74
2021272 CIF
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C20 H42 Mo6 N4 Ni O28P -19.1173; 10.3631; 10.7022
85.653; 77.403; 83.439
979Duan, Fengxue; Liu, Xiaoting; Xu, Wei; Tao, Yanchun; Li, Bao; Wu, Lixin
Supramolecular interaction-induced assemblies of polyanions and 2-aminopyridinium in two polyoxometalate-based hybrids
Acta Crystallographica Section C, 2018, 74
2021273 CIF
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C26 H68 Fe2 Mo12 N4 O76 P8 Sr2P -111.385; 14.121; 15.126
69.259; 82.422; 88.086
2254.1Tian, Xuerui; Xin, Xing; Gao, Yuanzhe; Dai, Dandan; Huang, Jinjin; Han, Zhangang
Crystal structures of hybrid completely reduced phosphomolybdates and catalytic performance applied as molecular catalysts for the reduction of chromium(VI)
Acta Crystallographica Section C, 2018, 74
2021274 CIF
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C28 H70 Ca2 Fe2 Mo12 N4 Na O74 P8C 1 2/c 121.317; 18.533; 22.838
90; 95.13; 90
8986Tian, Xuerui; Xin, Xing; Gao, Yuanzhe; Dai, Dandan; Huang, Jinjin; Han, Zhangang
Crystal structures of hybrid completely reduced phosphomolybdates and catalytic performance applied as molecular catalysts for the reduction of chromium(VI)
Acta Crystallographica Section C, 2018, 74
2021275 CIF
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C36 H68 Fe Mo12 N6 O70 P8P 1 21/c 111.8121; 22.6484; 16.0089
90; 98.701; 90
4233.5Tian, Xuerui; Xin, Xing; Gao, Yuanzhe; Dai, Dandan; Huang, Jinjin; Han, Zhangang
Crystal structures of hybrid completely reduced phosphomolybdates and catalytic performance applied as molecular catalysts for the reduction of chromium(VI)
Acta Crystallographica Section C, 2018, 74
2021276 CIF
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Paper
C15 H17 Cl N4 OP -19.101; 13.177; 13.328
70.334; 89.469; 86.582
1502.34Żesławska, Ewa; Nitek, Wojciech; Tejchman, Waldemar; Handzlik, Jadwiga
Influence of 3-{5-[4-(diethylamino)benzylidene]rhodanine}propionic acid on the conformation of 5-(4-chlorobenzylidene)-2-(4-methylpiperazin-1-yl)-3<i>H</i>-imidazol-4(5<i>H</i>)-one
Acta Crystallographica Section C, 2018, 74
2021277 CIF
HKL
Paper
C32 H37 Cl N6 O4 S2P -110.937; 11.384; 14.488
77.45; 81.731; 68.704
1636.3Żesławska, Ewa; Nitek, Wojciech; Tejchman, Waldemar; Handzlik, Jadwiga
Influence of 3-{5-[4-(diethylamino)benzylidene]rhodanine}propionic acid on the conformation of 5-(4-chlorobenzylidene)-2-(4-methylpiperazin-1-yl)-3<i>H</i>-imidazol-4(5<i>H</i>)-one
Acta Crystallographica Section C, 2018, 74
2021278 CIF
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Paper
C73 H152.95 Al Mo6 N5 O32.73P b c a16.1062; 26.512; 45.569
90; 90; 90
19458Gumerova, Nadiia I.; Blazevic, Amir; Caldera Fraile, Tania; Roller, Alexander; Giester, Gerald; Rompel, Annette
Synthesis and characterization of hybrid Anderson hexamolybdoaluminates(III) functionalized with indometacin or cinnamic acid
Acta Crystallographica Section C, 2018, 74
2021279 CIF
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Paper
C71 H150 Al Cl Mo6 N5 O36P b c a21.8904; 23.9848; 37.719
90; 90; 90
19803.9Gumerova, Nadiia I.; Blazevic, Amir; Caldera Fraile, Tania; Roller, Alexander; Giester, Gerald; Rompel, Annette
Synthesis and characterization of hybrid Anderson hexamolybdoaluminates(III) functionalized with indometacin or cinnamic acid
Acta Crystallographica Section C, 2018, 74
2021280 CIF
HKL
Paper
C11 H15 Br N2 OP 327.3942; 7.3942; 17.4657
90; 90; 120
826.99Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021281 CIF
HKL
Paper
C11 H15 I N2 OP 327.522; 7.522; 18.5124
90; 90; 120
907.11Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021282 CIF
HKL
Paper
C11 H15 Cl N2 O5P 21 21 216.8719; 18.8925; 19.1239
90; 90; 90
2482.8Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021283 CIF
HKL
Paper
C22 H30 I4 N4 O2P 17.5105; 7.5353; 13.8994
79.612; 75.806; 61.115
665.96Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021284 CIF
HKL
Paper
C11 H17 Cl N2 O2P 1 21 17.6327; 10.451; 7.6553
90; 108.559; 90
578.9Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021285 CIF
HKL
Paper
C11 H17 I N2 O2P 1 21 17.7268; 10.4304; 8.0655
90; 108.341; 90
617.01Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021286 CIF
HKL
Paper
C11 H17 N3 O5P 1 21 17.6216; 10.4582; 8.4325
90; 113.071; 90
618.38Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021287 CIF
HKL
Paper
C22 H31 Br3 N4 O2P 1 21 110.78898; 7.84934; 14.37986
90; 97.4435; 90
1207.52Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021288 CIF
HKL
Paper
C22 H31 I3 N4 O2P 21 21 217.9767; 14.1131; 25.725
90; 90; 90
2896Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021289 CIF
HKL
Paper
C22 H31 I5 N4 O2P 21 21 217.8269; 19.3211; 19.9592
90; 90; 90
3018.32Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021290 CIF
HKL
Paper
C22 H31 I7 N4 O2P 21 21 217.8686; 19.4183; 21.855
90; 90; 90
3339.33Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021291 CIF
HKL
Paper
C11 H16 Cl2 N2 O9P 21 21 218.0018; 11.7602; 16.421
90; 90; 90
1545.3Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021292 CIF
HKL
Paper
C11 H22 Cl2 N2 O4P 1 21 17.3551; 16.5198; 7.4476
90; 119.027; 90
791.25Owczarzak, Agata; Przybył, Anna K.; Kubicki, Maciej
Different cationic forms of (‒)-cytisine in the crystal structures of its simple inorganic salts
Acta Crystallographica Section C, 2018, 74
2021293 CIF
HKL
Paper
C12 H16 Cu2 Mo6 N8 O22P -18.065; 10.293; 10.837
64.09; 75.186; 71.141
758.8Sang, Xiao-Jing; Feng, Shu-Li; Lu, Ying; Zhang, Yue-Xian; Su, Fang; Zhang, Lan-Cui; Zhu, Zai-Ming
A new hexamolybdate-based copper‒2,2'-biimidazole coordination polymer serving as an acid catalyst and support for enzyme immobilization
Acta Crystallographica Section C, 2018, 74
2021294 CIF
HKL
Paper
C11 H31 Mo12 N7 O50 P TbP -111.594; 15.198; 15.292
80.195; 87.94; 75.052
2565.2Luo, Xi-Ming; Cui, Chen-Hui; Cao, Jia-Peng; Lin, Qing-Fang; Xu, Yan
Two new POM-based compounds modified by lanthanide‒Schiff base complexes with interesting NLO properties
Acta Crystallographica Section C, 2018, 74
2021295 CIF
HKL
Paper
C11 H31 Dy Mo12 N7 O50 PP -111.566; 15.218; 15.257
80.092; 87.602; 75.013
2555.4Luo, Xi-Ming; Cui, Chen-Hui; Cao, Jia-Peng; Lin, Qing-Fang; Xu, Yan
Two new POM-based compounds modified by lanthanide‒Schiff base complexes with interesting NLO properties
Acta Crystallographica Section C, 2018, 74
2021296 CIF
HKL
Paper
C22 H23 N3 SC 1 2/c 120.135; 6.826; 29.027
90; 100.759; 90
3919Karakurt, Tuncay
Investigation of the molecular structure of 4-(3-methyl-3-phenylcyclobutyl)-2-[2-(3-methylbenzylidene)hydrazinyl]thiazole in the gas and solid phases
Acta Crystallographica Section C, 2018, 74
2021297 CIF
HKL
C22 H27 Cl F N3 O3 SC 1 2/c 121.1233; 6.4503; 33.9243
90; 95.453; 90
4601.3Kalinowska-Tłuścik, Justyna; Piaskowska, Agata; Kołaczkowski, Marcin
Multifunctional arylsulfonamide derivatives with 5-HT~6~/5-HT~7~ receptor antagonistic activity: a structural study
Acta Crystallographica Section C, 2018, 74
2021298 CIF
HKL
C25 H28 Cl F2 N3 O3 S2P 1 21/c 15.996; 41.1095; 10.4904
90; 103.972; 90
2509.3Kalinowska-Tłuścik, Justyna; Piaskowska, Agata; Kołaczkowski, Marcin
Multifunctional arylsulfonamide derivatives with 5-HT~6~/5-HT~7~ receptor antagonistic activity: a structural study
Acta Crystallographica Section C, 2018, 74
2021299 CIF
HKL
C24 H26 Cl2 F N3 O3 S2P 1 21/c 121.8891; 6.958; 17.7899
90; 109.558; 90
2553.15Kalinowska-Tłuścik, Justyna; Piaskowska, Agata; Kołaczkowski, Marcin
Multifunctional arylsulfonamide derivatives with 5-HT~6~/5-HT~7~ receptor antagonistic activity: a structural study
Acta Crystallographica Section C, 2018, 74
2021300 CIF
HKL
C21 H23 Cl2 F2 N3 O3 SP 1 21/n 15.7077; 9.7798; 41.228
90; 91.123; 90
2300.91Kalinowska-Tłuścik, Justyna; Piaskowska, Agata; Kołaczkowski, Marcin
Multifunctional arylsulfonamide derivatives with 5-HT~6~/5-HT~7~ receptor antagonistic activity: a structural study
Acta Crystallographica Section C, 2018, 74
2021301 CIF
HKL
Paper
C9 H13 N O2P 1 21/n 18.768; 11.935; 9.001
90; 113.623; 90
863Fujii, Isao
Crystal structures of racemic and enantiopure synephrine correlated with physicochemical properties from IR spectroscopy and thermal analysis
Acta Crystallographica Section C, 2018, 74
2021302 CIF
HKL
Paper
C9 H13 N O2P 21 21 216.5581; 7.8144; 17.137
90; 90; 90
878.2Fujii, Isao
Crystal structures of racemic and enantiopure synephrine correlated with physicochemical properties from IR spectroscopy and thermal analysis
Acta Crystallographica Section C, 2018, 74
2021303 CIF
HKL
Paper
C28 H42 Cd2 N4 O19P 1 21 19.2072; 15.0256; 13.6139
90; 106.177; 90
1808.8Zhang, Hong-Tao; Wang, Xiao-Long
A new twofold interpenetrated two-dimensional cadmium(II) coordination polymer constructed from 2,2'-(benzene-1,4-dicarboxamido)dipropionate
Acta Crystallographica Section C, 2018, 74
2021304 CIFC14 H14 N2P 1 21/c 124.775; 5.5195; 8.1622
90; 95.759; 90
1110.5Tan, Xue-Jie; Zhao, Qing-Zhe; Li, Kun; Hu, Yong-Ji; Zhang, Jing-Chao
Order and disorder in (<i>E</i>)-[1-(biphenyl-4-yl)ethylidene]hydrazine: a structural, spectroscopic and theoretical study
Acta Crystallographica Section C, 2018, 74
2021305 CIFC14 H14 N2P 1 21/c 124.764; 5.5162; 8.1487
90; 95.705; 90
1107.6Tan, Xue-Jie; Zhao, Qing-Zhe; Li, Kun; Hu, Yong-Ji; Zhang, Jing-Chao
Order and disorder in (<i>E</i>)-[1-(biphenyl-4-yl)ethylidene]hydrazine: a structural, spectroscopic and theoretical study
Acta Crystallographica Section C, 2018, 74
2021306 CIF
HKL
Paper
C14 H14 N2P 1 21/c 124.74; 5.5154; 8.1367
90; 95.727; 90
1104.72Tan, Xue-Jie; Zhao, Qing-Zhe; Li, Kun; Hu, Yong-Ji; Zhang, Jing-Chao
Order and disorder in (<i>E</i>)-[1-(biphenyl-4-yl)ethylidene]hydrazine: a structural, spectroscopic and theoretical study
Acta Crystallographica Section C, 2018, 74
2021307 CIF
HKL
Paper
C14 H14 N2P 1 21/c 124.8153; 5.5146; 8.1513
90; 95.719; 90
1109.92Tan, Xue-Jie; Zhao, Qing-Zhe; Li, Kun; Hu, Yong-Ji; Zhang, Jing-Chao
Order and disorder in (<i>E</i>)-[1-(biphenyl-4-yl)ethylidene]hydrazine: a structural, spectroscopic and theoretical study
Acta Crystallographica Section C, 2018, 74
2021308 CIF
HKL
Paper
C19 H17 N O SP 1 21/c 117.0498; 5.7778; 18.1012
90; 117.359; 90
1583.7Ho, Douglas M.; Zdilla, Michael J.
The solid-state conformation of the topical antifungal agent <i>O</i>-naphthalen-2-yl <i>N</i>-methyl-<i>N</i>-(3-methylphenyl)carbamothioate
Acta Crystallographica Section C, 2018, 74
2021309 CIF
HKL
Paper
C11 H12 I N O2P 1 21/c 110.5193; 12.2078; 8.8674
90; 93.763; 90
1136.27Piontek, Aleksandra; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal
Structures and energetic properties of 4-halobenzamides
Acta Crystallographica Section C, 2018, 74
2021310 CIF
HKL
Paper
C11 H12 Br N O2P 319.9577; 9.9577; 9.8213
90; 90; 120
843.37Piontek, Aleksandra; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal
Structures and energetic properties of 4-halobenzamides
Acta Crystallographica Section C, 2018, 74
2021311 CIF
HKL
Paper
C11 H12 Cl N O2P 319.9808; 9.9808; 9.5853
90; 90; 120
826.93Piontek, Aleksandra; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal
Structures and energetic properties of 4-halobenzamides
Acta Crystallographica Section C, 2018, 74
2021312 CIF
HKL
Paper
C11 H12 F N O2P b c a7.3584; 7.2979; 37.576
90; 90; 90
2017.9Piontek, Aleksandra; Bisz, Elwira; Dziuk, Błażej; Szostak, Roman; Szostak, Michal
Structures and energetic properties of 4-halobenzamides
Acta Crystallographica Section C, 2018, 74
2021313 CIF
HKL
Paper
C10 H10 N2R -3 :H29.196; 29.196; 5.4212
90; 90; 120
4002Macías, Mario A.; Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Portilla, Jaime
Studies <i>via</i> X-ray analysis on intermolecular interactions and energy frameworks based on the effects of substituents of three 4-aryl-2-methyl-1<i>H</i>-imidazoles of different electronic nature and their <i>in vitro</i> antifungal evaluation
Acta Crystallographica Section C, 2018, 74
2021314 CIF
HKL
Paper
C10 H10 Cl N2 O0.5P 1 21/n 110.4027; 18.093; 11.1496
90; 101.573; 90
2055.9Macías, Mario A.; Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Portilla, Jaime
Studies <i>via</i> X-ray analysis on intermolecular interactions and energy frameworks based on the effects of substituents of three 4-aryl-2-methyl-1<i>H</i>-imidazoles of different electronic nature and their <i>in vitro</i> antifungal evaluation
Acta Crystallographica Section C, 2018, 74
2021315 CIF
HKL
Paper
C11 H12 N2 OP 2 21 217.153; 7.4824; 21.437
90; 90; 90
1147.3Macías, Mario A.; Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Portilla, Jaime
Studies <i>via</i> X-ray analysis on intermolecular interactions and energy frameworks based on the effects of substituents of three 4-aryl-2-methyl-1<i>H</i>-imidazoles of different electronic nature and their <i>in vitro</i> antifungal evaluation
Acta Crystallographica Section C, 2018, 74
2021316 CIF
HKL
Paper
C6 H5 Br N2 O2P 1 c 111.1643; 3.8275; 17.2764
90; 98.662; 90
729.82Marek, Paulina H.; Urban, Mateusz; Madura, Izabela D.
The study of interactions with a halogen atom: influence of NH~2~ group insertion on the crystal structures of <i>meta</i>-bromonitrobenzene derivatives
Acta Crystallographica Section C, 2018, 74
2021317 CIF
HKL
Paper
C6 H5 Br N2 O2P 1 21/n 14.4477; 11.4469; 13.8244
90; 94.635; 90
701.53Marek, Paulina H.; Urban, Mateusz; Madura, Izabela D.
The study of interactions with a halogen atom: influence of NH~2~ group insertion on the crystal structures of <i>meta</i>-bromonitrobenzene derivatives
Acta Crystallographica Section C, 2018, 74
2021318 CIF
HKL
Paper
C44 H24 Cu2 N16P -19.5158; 9.6393; 11.0824
88.441; 71.611; 81.106
952.78Potočňák, Ivan; Bukrynov, Oleksandr; Ráczová, Katarína; Čižmár, Erik; Vitushkina, Svitlana; Váhovská, Lucia; Dušek, Michal; Štarha, Pavel
Low-dimensional compounds containing cyanido groups. Part XXXV. Structure, spectral, thermal and magnetic properties of a binuclear Cu^II^‒biquinoline complex with bridging and terminal dicyanamide ligands
Acta Crystallographica Section C, 2018, 74
2021319 CIF
HKL
Paper
C14 H18 Cu1.5 N O7P 1 21/n 111.1485; 10.8671; 13.2125
90; 107.631; 90
1525.5Sun, Guanghui; Xie, Weilian; Xiao, Hong; Xu, Guohai
Controlled interpenetration of 4^4^ networks: syntheses and structures of two Cu~3~-cluster coordination polymers
Acta Crystallographica Section C, 2018, 74
2021320 CIF
HKL
Paper
C52 H52 Cu3 N2 O18P 1 21/n 116.0209; 9.3823; 16.6801
90; 99.563; 90
2472.4Sun, Guanghui; Xie, Weilian; Xiao, Hong; Xu, Guohai
Controlled interpenetration of 4^4^ networks: syntheses and structures of two Cu~3~-cluster coordination polymers
Acta Crystallographica Section C, 2018, 74
2021321 CIF
HKL
Paper
C18 H88 B3 Ba9 Co3 N6 O155 W33P 1 21/c 122.1764; 38.1422; 23.9668
90; 114.657; 90
18424Xu, Jingjing; Gable, Robert W.; Ritchie, Chris
Targeted synthesis of a polypyridyl polyoxometalate coordination complex using microwave-assisted reaction conditions
Acta Crystallographica Section C, 2018, 74
2021322 CIF
HKL
Paper
C32 H24 Cl2 N4 O4 RuP -110.8018; 11.6708; 14.248
93.707; 105.555; 116.417
1514.1Guajardo, Juana; Ibañez, Andrés; Guerchais, Veronique; Vega, Andrés; Moya, Sergio; Aguirre, Pedro
Ruthenium(II)‒carbonyl complexes containing two <i>N</i>-monodentate 1,8-naphthyridine ligands: active catalysis in transfer hydrogenation reactions
Acta Crystallographica Section C, 2018, 74
2021323 CIF
HKL
Paper
C32 H24 Cl2 N4 O4 RuC 1 2/c 119.106; 12.1967; 29.42
90; 94.918; 90
6830.5Guajardo, Juana; Ibañez, Andrés; Guerchais, Veronique; Vega, Andrés; Moya, Sergio; Aguirre, Pedro
Ruthenium(II)‒carbonyl complexes containing two <i>N</i>-monodentate 1,8-naphthyridine ligands: active catalysis in transfer hydrogenation reactions
Acta Crystallographica Section C, 2018, 74
2021324 CIF
HKL
Paper
C16 H17 N3 O3 SC 1 2/c 120.764; 6.6904; 24.174
90; 97.1; 90
3332.5Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Comparison of the crystal structures and Hirshfeld surface analysis of five <i>N</i>-(4-methylbenzenesulfonyl)glycine hydrazone derivatives
Acta Crystallographica Section C, 2018, 74, 1553-1560
2021325 CIF
HKL
Paper
C16 H16 Br N3 O3 SP -16.7308; 10.322; 13.723
75.562; 85.556; 75.046
891.94Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Comparison of the crystal structures and Hirshfeld surface analysis of five <i>N</i>-(4-methylbenzenesulfonyl)glycine hydrazone derivatives
Acta Crystallographica Section C, 2018, 74, 1553-1560
2021326 CIF
HKL
Paper
C16 H16 Cl N3 O3 SP -16.7101; 10.359; 13.5
76.049; 85.846; 74.823
878.9Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Comparison of the crystal structures and Hirshfeld surface analysis of five <i>N</i>-(4-methylbenzenesulfonyl)glycine hydrazone derivatives
Acta Crystallographica Section C, 2018, 74, 1553-1560
2021327 CIF
HKL
Paper
C18 H22 N4 O3 SP -16.931; 11.076; 12.935
87.37; 81.44; 74.42
945.8Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Comparison of the crystal structures and Hirshfeld surface analysis of five <i>N</i>-(4-methylbenzenesulfonyl)glycine hydrazone derivatives
Acta Crystallographica Section C, 2018, 74, 1553-1560
2021328 CIF
HKL
Paper
C17 H19 N3 O4 SP -16.8887; 10.778; 12.411
95.26; 93.43; 104.82
883.7Purandara, H.; Foro, Sabine; Thimme Gowda, B.
Comparison of the crystal structures and Hirshfeld surface analysis of five <i>N</i>-(4-methylbenzenesulfonyl)glycine hydrazone derivatives
Acta Crystallographica Section C, 2018, 74, 1553-1560
2021329 CIF
HKL
Paper
C24 H26 Cd N4 O6P -19.643; 10.934; 11.787
95.776; 94.925; 91.207
1231.4Chen, Ning-Ning; Ni, Jian-Ning; Wang, Jun
A new two-dimensional Cd^II^ coordination polymer based on 1,3-bis(2-methyl-1<i>H</i>-imidazol-1-yl)benzene and 1,3-phenylenediacetic acid: synthesis, crystal structure and physical properties
Acta Crystallographica Section C, 2018, 74
2021330 CIF
HKL
Paper
C25.5 H29 N O2P -111.9894; 13.6171; 14.3939
89.467; 74.383; 68.125
2089.34Macías, Mario A.; Sanabria, Elkin E.; Acosta-Quintero, Lina M.; Palma, Alirio; Suescun, Leopoldo
Observation of an infrequent enantiomer/conformer substitutional disorder in ethyl 13-ethyl-4-oxo-8,13-dihydro-4H-benzo[5,6]azepino[3,2,1-ij]quinoline-5-carboxylate heptane hemisolvate
Acta Crystallographica Section C Structural Chemistry, 2018, 74
2021331 CIF
HKL
Paper
C40 H26 Cd2 N2 O10P -17.6924; 10.128; 12.24
84.85; 85.98; 83.7
942.3Li, Ni-Ya; Liu, Dong
Synthesis, structure and photoluminescence properties of a three-dimensional cadmium(II) (4,5)-connected coordination network
Acta Crystallographica Section C, 2018, 74
2021332 CIF
HKL
Paper
Fe Na4.96 O12 Si4R -3 c21.418; 21.418; 12.2911
90; 90; 120
4882.9Ahmadzadeh, Mostafa; Olds, Travis A.; Scrimshire, Alex; Bingham, Paul A.; McCloy, John S.
Structure and properties of Na~5~FeSi~4~O~12~ crystallized from 5Na~2~O‒Fe~2~O~3~‒8SiO~2~ glass
Acta Crystallographica Section C, 2018, 74
2021333 CIF
HKL
Paper
Ag1.01 In Mo3 O12 Rb2R -3 c :H10.3982; 10.3982; 38.858
90; 90; 120
3638.5Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Kadyrova, Yulia M.; Solodovnikova, Zoya A.; Yudin, Vasiliy N.; Stefanovich, Sergey Yu.; Khaikina, Elena G.
New triple molybdate Rb~2~AgIn(MoO~4~)~3~: synthesis, framework crystal structure and ion-transport behaviour
Acta Crystallographica Section C, 2018, 74
2021334 CIF
HKL
Paper
C12 H15 N O2C 1 2/c 18.768; 11.115; 22.3
90; 91.59; 90
2172Truong, Khai-Nghi; Meven, Martin; Englert, Ulli
Proton disorder in a short intramolecular hydrogen bond investigated by single-crystal neutron diffraction at 2.5 and 170K
Acta Crystallographica Section C, 2018, 74
2021335 CIF
HKL
Paper
C12 H15 N O2C 1 2/c 18.8583; 11.1031; 22.4335
90; 91.876; 90
2205.3Truong, Khai-Nghi; Meven, Martin; Englert, Ulli
Proton disorder in a short intramolecular hydrogen bond investigated by single-crystal neutron diffraction at 2.5 and 170K
Acta Crystallographica Section C, 2018, 74
2021336 CIF
HKL
Paper
C12 H15 N O2C 1 2/c 18.8583; 11.1031; 22.4335
90; 91.876; 90
2205.3Truong, Khai-Nghi; Meven, Martin; Englert, Ulli
Proton disorder in a short intramolecular hydrogen bond investigated by single-crystal neutron diffraction at 2.5 and 170K
Acta Crystallographica Section C, 2018, 74
2021337 CIF
HKL
Paper
C67 H70 Br2 Cl4 Co N10 O14P -113.2358; 16.3228; 17.8925
95.741; 107.412; 105.197
3492Yuan, Juan; Wang, Xia; Zhang, Nan; Liu, Mei-Jiao; Kou, Hui-Zhong
Two new cobalt(II) rhodamine 6G hydrazone complexes: structure, fluorescence and magnetism
Acta Crystallographica Section C, 2018, 74
2021338 CIF
HKL
Paper
C67 H70 B2 Br2 Cl2 Co F8 N10 O6P -113.182; 16.2426; 17.7898
95.8495; 107.33; 104.713
3451.2Yuan, Juan; Wang, Xia; Zhang, Nan; Liu, Mei-Jiao; Kou, Hui-Zhong
Two new cobalt(II) rhodamine 6G hydrazone complexes: structure, fluorescence and magnetism
Acta Crystallographica Section C, 2018, 74
2021339 CIF
HKL
Paper
C14 H21 N3 O SP 21 21 217.1606; 7.2405; 28.2842
90; 90; 90
1466.43N'ait Ousidi, Abdellah; Ait Itto, Moulay Youssef; Auhmani, Aziz; Riahi, Abdelkhalek; Robert, Anthony; Auhmani, Abdelwahed; Daran, Jean-Claude
New polysubstituted monoterpenic thiazolidinones: synthesis, spectroscopic and crystal structure studies
Acta Crystallographica Section C, 2018, 74
2021340 CIF
HKL
Paper
C16 H24 N4 O SP 21 21 2111.4988; 13.5379; 22.3107
90; 90; 90
3473.1N'ait Ousidi, Abdellah; Ait Itto, Moulay Youssef; Auhmani, Aziz; Riahi, Abdelkhalek; Robert, Anthony; Auhmani, Abdelwahed; Daran, Jean-Claude
New polysubstituted monoterpenic thiazolidinones: synthesis, spectroscopic and crystal structure studies
Acta Crystallographica Section C, 2018, 74
2021341 CIF
HKL
Paper
C30 H32 N2 O6 P2P 110.2789; 10.8253; 15.02
101.229; 105.716; 109.782
1436.22Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Nečas, Marek; Bertolasi, Valerio
A combined X-ray crystallography and theoretical study of N—H···O<i>X</i> (<i>X</i> is =P and —C) hydrogen bonds in two new structures with a (C—O)~2~(N)P(=<i>Y</i>) (<i>Y</i> is O and S) skeleton
Acta Crystallographica Section C, 2018, 74
2021342 CIF
HKL
Paper
C10 H18 N2 O4 P2 S2P 1 21/a 113.2517; 10.0091; 13.958
90; 112.931; 90
1705.05Vahdani Alviri, Banafsheh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Nečas, Marek; Bertolasi, Valerio
A combined X-ray crystallography and theoretical study of N—H···O<i>X</i> (<i>X</i> is =P and —C) hydrogen bonds in two new structures with a (C—O)~2~(N)P(=<i>Y</i>) (<i>Y</i> is O and S) skeleton
Acta Crystallographica Section C, 2018, 74
2021343 CIF
HKL
C30 H22 F4 N4P 1 21/n 110.148; 11.2687; 11.5255
90; 102.371; 90
1287.4Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021344 CIF
HKL
C30 H22 F4 N4P 1 21/n 15.6693; 7.642; 30.891
90; 90.465; 90
1338.3Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021345 CIF
HKL
C30 H22 F4 N4P -14.9137; 15.0053; 17.7776
86.452; 86.481; 89.888
1305.79Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021346 CIF
HKL
C30 H22 Cl4 N4P -16.0349; 7.3474; 16.6718
93.255; 98.722; 104.473
704.03Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021347 CIF
HKL
C30 H22 Cl4 N4P 1 21/n 110.42; 12.5276; 11.2084
90; 103.682; 90
1421.6Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021348 CIF
HKL
C34 H34 N4P -17.6122; 10.7586; 18.3363
104.238; 95.169; 107.232
1368.51Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021349 CIF
HKL
C34 H34 N4P 17.727; 8.9264; 10.491
97.989; 96.215; 106.294
679.5Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021350 CIF
HKL
C38 H46 N8P 1 21 111.8988; 8.1189; 18.4205
90; 98.961; 90
1757.8Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021351 CIF
HKL
C38 H46 N8P -17.5278; 10.1875; 12.0834
104.338; 95.713; 98.717
878.3Dwivedi, Bhavna; Das, Dinabandhu
Polymorphism in some new bis-hydrazone compounds
Acta Crystallographica Section C, 2018, 74
2021352 CIF
HKL
Paper
C15.5 H14 Br Cu I N2 O1.5 SP -14.0594; 10.8684; 20.7336
102.079; 94.047; 94.299
888.48Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław
Copper(I) iodide ribbons coordinated with thiourea derivatives
Acta Crystallographica Section C, 2018, 74
2021353 CIF
HKL
Paper
C14 H10 Cu2 I2 N2 O SP 1 21 112.688; 4.1152; 15.8952
90; 100.258; 90
816.68Rosiak, Damian; Okuniewski, Andrzej; Chojnacki, Jarosław
Copper(I) iodide ribbons coordinated with thiourea derivatives
Acta Crystallographica Section C, 2018, 74
2021354 CIF
HKL
Paper
C80 H72 Fe2 N12P 1 21/c 121.758; 12.7682; 31.382
90; 109.191; 90
8233.8Lee, Wei-Tsung; Zeller, Matthias; Upp, David; Politanska, Yuliya; Steinman, Doug; Al-Assil, Talal; Becker, Daniel P.
Iron(II) complexes of dimethyltriazacyclophane
Acta Crystallographica Section C, 2018, 74
2021355 CIF
HKL
Paper
C48 H52 Fe N6 O2P b c a15.9624; 15.8047; 32.747
90; 90; 90
8261.4Lee, Wei-Tsung; Zeller, Matthias; Upp, David; Politanska, Yuliya; Steinman, Doug; Al-Assil, Talal; Becker, Daniel P.
Iron(II) complexes of dimethyltriazacyclophane
Acta Crystallographica Section C, 2018, 74
2021356 CIF
HKL
Paper
C20 H27 Cl O2C 1 2 112.984; 6.2961; 21.265
90; 94.306; 90
1733.5Almagro, Luis; Nogueras, Manuel; Suárez, Margarita; Cobo, Justo; Glidewell, Christopher
Chloro‒formyl steroids as precursors for hybrid heterosteroids: synthesis, spectroscopic characterization, and molecular and supramolecular structures
Acta Crystallographica Section C, 2018, 74
2021357 CIF
HKL
Paper
C28 H45 Cl OP 21 21 218.0097; 14.8313; 20.5873
90; 90; 90
2445.7Almagro, Luis; Nogueras, Manuel; Suárez, Margarita; Cobo, Justo; Glidewell, Christopher
Chloro‒formyl steroids as precursors for hybrid heterosteroids: synthesis, spectroscopic characterization, and molecular and supramolecular structures
Acta Crystallographica Section C, 2018, 74
2021358 CIF
HKL
Paper
C26 H37 Cl O4P 21 21 217.0444; 10.8756; 30.491
90; 90; 90
2335.98Almagro, Luis; Nogueras, Manuel; Suárez, Margarita; Cobo, Justo; Glidewell, Christopher
Chloro‒formyl steroids as precursors for hybrid heterosteroids: synthesis, spectroscopic characterization, and molecular and supramolecular structures
Acta Crystallographica Section C, 2018, 74
2021359 CIF
HKL
Paper
C34 H38 N4 OP -18.1685; 11.4832; 30.7638
99.9705; 94.1047; 90.9084
2833.62Główka, Marek L.; Kałużyńska, Sylwia; Krause, Malwina; Gobis, Katarzyna; Foks, Henryk; Szczesio, Małgorzata; Olczak, Andrzej
The structures of benzimidazole derivatives and their potential as tuberculostatics
Acta Crystallographica Section C, 2018, 74
2021360 CIF
HKL
Paper
C17.5 H18 N2 O0.5C 1 c 113.095; 9.2984; 23.685
90; 93.95; 90
2877.1Główka, Marek L.; Kałużyńska, Sylwia; Krause, Malwina; Gobis, Katarzyna; Foks, Henryk; Szczesio, Małgorzata; Olczak, Andrzej
The structures of benzimidazole derivatives and their potential as tuberculostatics
Acta Crystallographica Section C, 2018, 74
2021361 CIF
HKL
Paper
C19 H18 N2 O4P 1 21/c 15.56861; 18.0016; 17.1528
90; 97.8415; 90
1703.39Główka, Marek L.; Kałużyńska, Sylwia; Krause, Malwina; Gobis, Katarzyna; Foks, Henryk; Szczesio, Małgorzata; Olczak, Andrzej
The structures of benzimidazole derivatives and their potential as tuberculostatics
Acta Crystallographica Section C, 2018, 74
2021362 CIF
HKL
Paper
C14 H11 Br3 N2P 1 21/c 18.538; 5.283; 32.801
90; 99.692; 90
1458.4Vande Velde, Christophe M. L.; Zeller, Matthias; Azov, Vladimir A.
Comparison of computationally cheap methods for providing insight into the crystal packing of highly bromomethylated azobenzenes
Acta Crystallographica Section C, 2018, 74
2021363 CIF
HKL
Paper
C14 H10 Br4 N2C 1 2/c 120.379; 8.6401; 9.8451
90; 114.797; 90
1573.7Vande Velde, Christophe M. L.; Zeller, Matthias; Azov, Vladimir A.
Comparison of computationally cheap methods for providing insight into the crystal packing of highly bromomethylated azobenzenes
Acta Crystallographica Section C, 2018, 74
2021364 CIF
HKL
Paper
C14 H11 Br3 N2P 1 21/c 19.1219; 16.904; 10.3633
90; 112.122; 90
1480.3Vande Velde, Christophe M. L.; Zeller, Matthias; Azov, Vladimir A.
Comparison of computationally cheap methods for providing insight into the crystal packing of highly bromomethylated azobenzenes
Acta Crystallographica Section C, 2018, 74
2021365 CIF
HKL
Paper
C14 H10 Br4 N2P -14.899; 8.294; 9.942
98.103; 103.64; 96.65
384Vande Velde, Christophe M. L.; Zeller, Matthias; Azov, Vladimir A.
Comparison of computationally cheap methods for providing insight into the crystal packing of highly bromomethylated azobenzenes
Acta Crystallographica Section C, 2018, 74
2021366 CIF
HKL
Paper
C14 H9 Br5 N2P -17.0161; 8.5634; 14.897
103.257; 102.974; 91.703
845.8Vande Velde, Christophe M. L.; Zeller, Matthias; Azov, Vladimir A.
Comparison of computationally cheap methods for providing insight into the crystal packing of highly bromomethylated azobenzenes
Acta Crystallographica Section C, 2018, 74
2021367 CIF
HKL
Paper
C10 H14 N2 O3 SP 1 21/n 14.6212; 12.5742; 19.3936
90; 92.869; 90
1125.51Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021368 CIF
HKL
Paper
C11 H16 N2 O3 SP 1 21 14.914; 12.945; 9.763
90; 103.474; 90
603.95Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021369 CIF
HKL
Paper
C18 H29 N3 O5 SP 21 21 218.3816; 9.6258; 24.297
90; 90; 90
1960.3Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021370 CIF
HKL
Paper
C16 H19 N3 O2 S2P 1 21/c 14.8156; 21.7395; 15.1912
90; 95.656; 90
1582.6Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021371 CIF
HKL
Paper
C10 H15 N3 O2 SP 1 21/c 112.8983; 9.8458; 18.2217
90; 98.25; 90
2290.1Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021372 CIF
HKL
Paper
C11 H17 N3 O2 SP 21 21 214.9625; 10.6358; 23.2402
90; 90; 90
1226.62Sharma, Anamika; Zamisa, Sizwe J.; Noki, Sikabwe; Almarhoon, Zainab; El-Faham, Ayman; de la Torre, Beatriz G.; Albericio, Fernando
Crystal structure, spectroscopic studies and theoretical studies of thiobarbituric acid derivatives: understanding the hydrogen-bonding patterns
Acta Crystallographica Section C, 2018, 74
2021373 CIF
HKL
Paper
C6 H13 N2 O5.5 SC 1 2/c 128.348; 9.672; 7.5667
90; 103.308; 90
2018.9Zick, Patricia L.; Geiger, David K.
Charge-assisted hydrogen bonding in three diaminobenzene salts
Acta Crystallographica Section C, 2018, 74
2021374 CIF
HKL
Paper
C6 H9 Cl N2 O4P 21 21 215.7979; 9.866; 15.421
90; 90; 90
882.1Zick, Patricia L.; Geiger, David K.
Charge-assisted hydrogen bonding in three diaminobenzene salts
Acta Crystallographica Section C, 2018, 74
2021375 CIF
HKL
Paper
C6 H10 Cl4 N2 ZnP n a 2114.007; 11.6085; 7.2286
90; 90; 90
1175.37Zick, Patricia L.; Geiger, David K.
Charge-assisted hydrogen bonding in three diaminobenzene salts
Acta Crystallographica Section C, 2018, 74
2021376 CIF
HKL
C32 H40 N4 O20 Zn2C 1 2/c 123.9306; 23.9322; 14.9917
90; 113.485; 90
7874.7Mao, Yimin; Zavalij, Peter Y.
Two- and three-dimensional coordination polymers based on zinc(II) and furan-2,5-dicarboxylic acid: structure variation due to metal-to-linker ratio
Acta Crystallographica Section C, 2018, 74
2021377 CIF
HKL
C37.25 H45.6 N5.1 O23.1 Zn3P 1 21/c 19.2803; 15.1916; 17.7731
90; 96.4221; 90
2489.97Mao, Yimin; Zavalij, Peter Y.
Two- and three-dimensional coordination polymers based on zinc(II) and furan-2,5-dicarboxylic acid: structure variation due to metal-to-linker ratio
Acta Crystallographica Section C, 2018, 74
2021378 CIF
Paper
C24 H27 Cl2 N O4 PtP -18.1252; 11.7042; 13.734
65.864; 84.716; 88.191
1186.82Chi, Nguyen Thi Thanh; Thong, Pham Van; Mai, Truong Thi Cam; Van Meervelt, Luc
Mixed natural arylolefin‒quinoline platinum(II) complexes: synthesis, structural characterization and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2018, 74
2021379 CIF
HKL
Paper
C24 H26 Cl N O5 PtP -18.3447; 11.9191; 12.9315
63.296; 84.618; 76.484
1117.08Chi, Nguyen Thi Thanh; Thong, Pham Van; Mai, Truong Thi Cam; Van Meervelt, Luc
Mixed natural arylolefin‒quinoline platinum(II) complexes: synthesis, structural characterization and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2018, 74
2021380 CIF
HKL
Paper
C24 H26 Cl N O5 PtP -19.7858; 11.0447; 11.8117
85.059; 73.685; 71.139
1159.41Chi, Nguyen Thi Thanh; Thong, Pham Van; Mai, Truong Thi Cam; Van Meervelt, Luc
Mixed natural arylolefin‒quinoline platinum(II) complexes: synthesis, structural characterization and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2018, 74
2021381 CIF
Paper
C25 H26 Cl N O6 PtP 1 21/c 115.6457; 9.7291; 16.6062
90; 111.15; 90
2357.5Chi, Nguyen Thi Thanh; Thong, Pham Van; Mai, Truong Thi Cam; Van Meervelt, Luc
Mixed natural arylolefin‒quinoline platinum(II) complexes: synthesis, structural characterization and <i>in vitro</i> cytotoxicity studies
Acta Crystallographica Section C, 2018, 74
2021382 CIF
HKL
Paper
C14 H10 Cl N OP -19.6212; 13.4483; 19.7967
72.681; 89.995; 69.051
2267.4Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021383 CIF
HKL
Paper
C14 H10 Cl N OP 1 21/c 112.7217; 4.8842; 19.9554
90; 108.577; 90
1175.33Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021384 CIF
HKL
Paper
C14 H10 Cl N OP 1 21/c 110.4274; 11.8586; 9.1689
90; 90.341; 90
1133.75Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021385 CIF
HKL
Paper
C14 H10 Cl N OP 1 21/c 110.5605; 12.0485; 9.1939
90; 89.288; 90
1169.72Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021386 CIF
HKL
Paper
C14 H10 Cl N OP 1 21/c 111.1067; 13.3924; 8.0288
90; 109.92; 90
1122.79Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021387 CIF
HKL
Paper
C14 H10 Cl N OP 1 21/c 111.1901; 13.6596; 8.0965
90; 109.996; 90
1162.96Wang, Bing; Fang, Qi
Structures and phase transition of three isomers of 1-phenylindolin-2-one derivatives: 6-chloro-1-phenylindolin-2-one, 4-chloro-1-phenylindolin-2-one and 1-(3-chlorophenyl)indolin-2-one
Acta Crystallographica Section C, 2018, 74
2021388 CIF
HKL
Paper
C24 H44 Bi4 I16 N8P 1 21/n 113.1008; 13.2084; 19.3147
90; 90.701; 90
3342Chen, Wei-Jun; Chu, Kai-Bin; Song, Jun-Ling
Low-dimensional bismuth(III) iodide hybrid material with high activity for the fast removal of rhodamine B
Acta Crystallographica Section C, 2018, 74
2021389 CIF
HKL
Paper
C19 H16 N2 O4P 1 21/n 116.3612; 8.4646; 23.6668
90; 108.718; 90
3104.3Shishkina, Svitlana V.; Levandovskiy, Igor A.; Ukrainets, Igor V.; Sidorenko, Lyudmila V.; Grinevich, Lina A.; Yanchuk, Igor B.
Polymorphic modifications of a 1<i>H</i>-pyrrolo[3,2,1-<i>ij</i>]quinoline-5-carboxamide possessing strong diuretic properties
Acta Crystallographica Section C, 2018, 74

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