Crystallography Open Database

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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
HKL
Paper
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
HKL
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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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Paper
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
HKL
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
HKL
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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Paper
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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Paper
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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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
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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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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
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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
HKL
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
HKL
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
HKL
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
HKL
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
HKL
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
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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
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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
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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
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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
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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
HKL
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
HKL
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
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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
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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
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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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Paper
C22 H16 Cl2 Co N8P 1 21/c 120.4923; 7.4278; 13.9819
90; 94.891; 90
2120.47Wang, Xue-Ru; Ma, Jian-Ping; Dong, Yu-Bin
Syntheses and structures of two new coordination polymers generated from a 4-aminotriazole-bridged organic ligand and Co^II^ salts
Acta Crystallographica Section C, 2017, 73, 247-253
2020813 CIF
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Paper
C14 H21 N O4P 1 21 18.7136; 6.3606; 13.3613
90; 100.22; 90
728.78Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020814 CIF
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Paper
C14 H21 N O4P 1 21 18.7007; 6.3466; 13.3458
90; 100.243; 90
725.21Żesławska, Ewa; Jakubowska, Anna; Nitek, Wojciech
Conformational study of the 3,6-dihydro-2<i>H</i>-1,4-oxazin-2-one fragment in 8-<i>tert</i>-butyl-7-methoxy-8-methyl-9-oxa-6-azaspiro[4.5]decane-2,10-dione stereoisomers
Acta Crystallographica Section C, 2017, 73, 556-562
2020815 CIF
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Paper
C32 H55 O5.5C 1 2 129.0091; 7.7205; 29.9984
90; 114.524; 90
6112.5Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020816 CIF
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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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Paper
C32 H54 O5P 1 21 110.91; 8.037; 17.018
90; 92.5; 90
1490.8Liu, Juan; Xu, Yang-Rong; An, Xing-Si; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of a 3-acetylated (20<i>S</i>,24<i>S</i>)-ocotillol-type saponin and its C-24 epimer
Acta Crystallographica Section C, 2017, 73, 464-469
2020818 CIF
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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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Paper
C30 H44 Fe N10 O8P 1 21/c 18.73056; 11.7379; 17.619
90; 102.142; 90
1765.17Tanaka, Rikako; Matsushita, Nobuyuki
A charge-transfer salt composed of methyl viologen and hexacyanidoferrate(II)
Acta Crystallographica Section C, 2017, 73, 476-480
2020820 CIF
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Paper
C22 H43 Cl Fe N O P3P 1 21/c 117.0243; 10.494; 15.1374
90; 109.09; 90
2555.6Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020821 CIF
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Paper
C23 H39 Cl Fe N2 P2P 1 21/n 17.6074; 18.2229; 19.1442
90; 92.3658; 90
2651.7Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020822 CIF
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Paper
C20 H34 Cl Fe N O2 P2P 1 21/c 113.7917; 14.6349; 11.2225
90; 90.729; 90
2265Holland, Amanda M.; Oliver, Allen G.; Iluc, Vlad M.
Iron pyrrole-based PNP pincer ligand complexes as catalyst precursors
Acta Crystallographica Section C, 2017, 73, 569-574
2020823 CIF
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Paper
C34 H26 Cd N2 O7P -18.073; 12.4019; 15.2718
106.744; 101.979; 96.647
1406.93Xie, Hua; Fang, Wang-Jian; Yao, Xiao-Qiang
A cadmium(II) coordination polymer with both polyrotaxane and polycatenane features constructed by a V-shaped semi-rigid ligand: synthesis and fluorescence properties
Acta Crystallographica Section C, 2017, 73, 541-545
2020824 CIF
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Paper
C14 H12 F3 I3 N2P 1 21/c 17.9818; 26.7046; 9.222
90; 115.398; 90
1775.69Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020825 CIF
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Paper
C19 H9 F3 I3 NP 1 21/c 110.5079; 12.5632; 15.1563
90; 102.49; 90
1953.47Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020826 CIF
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Paper
C18 H8 F3 I3 N2P 1 21/c 18.6445; 14.0472; 15.8147
90; 97.662; 90
1903.25Szell, Patrick M. J.; Gabriel, Shaina A.; Gill, Russell D. D.; Wan, Shirley Y. H.; Gabidullin, Bulat; Bryce, David L.
^13^C and ^19^F solid-state NMR and X-ray crystallographic study of halogen-bonded frameworks featuring nitrogen-containing heterocycles
Acta Crystallographica Section C, 2017, 73, 157-167
2020827 CIF
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Paper
C24 H18 Cu N2 O6P 1 21/c 111.731; 14.274; 13.211
90; 100.862; 90
2172.5Tang, Long; Zhang, Juan; Liu, Xiao-Xia; Wang, Ji-Jiang; Fu, Feng
A two-dimensional copper(II) coordination polymer based on 2,4′-oxybis(benzoate) and 4,4′-bipyridine
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020832 CIF
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Paper
C38 H35 N O2 P2P 1 21 111.7931; 10.4209; 14.0792
90; 111.081; 90
1614.46Balogh, Szabolcs; Farkas, Gergely; Holczbauer, Tamás; Bakos, József
Origin of the chemical stability of phosphine-phosphoramidites: structural study of an UPPhos-type crystal and application of UPPhos in the asymmetric hydrogenation of imines
Acta Crystallographica Section C, 2017, 73
2020833 CIF
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Paper
C15 H9 Cr F O3P 1 21/c 17.0166; 27.4725; 7.1101
90; 113.738; 90
1254.61Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020834 CIF
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Paper
C15 H9 Cr F O3P 1 21/c 17.0616; 28.3503; 7.0571
90; 114.324; 90
1287.41Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020835 CIF
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Paper
C12 H9 FF d d 212.9824; 23.0588; 5.7527
90; 90; 90
1722.1Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020836 CIF
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Paper
C12 H9 FP b c n5.6462; 20.739; 7.292
90; 90; 90
853.9Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J.
Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls
Acta Crystallographica Section C, 2017, 73
2020837 CIF
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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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Paper
C22 H28 O7P 1 21/c 14.9801; 17.4771; 23.1
90; 94.124; 90
2005.37Wiedemann, Dennis; Kohl, Julia
Invariom-model refinement and Hirshfeld surface analysis of well-ordered solvent-free dibenzo-21-crown-7
Acta Crystallographica Section C Structural Chemistry, 2017, 73
2020842 CIF
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Paper
C6 F3 I3P 1 21/c 19.3455; 13.1854; 9.2185
90; 118.466; 90
998.61Raffo, Pablo A.; Suárez, Sebastián; Fantoni, Adolfo C.; Baggio, Ricardo; Cukiernik, Fabio D.
Polymorphism of a widely used building block for halogen-bonded assemblies: 1,3,5-trifluoro-2,4,6-triiodobenzene
Acta Crystallographica Section C, 2017, 73
2020843 CIF
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Paper
C24 H28 N6 O4P c c n9.1077; 13.5893; 19.476
90; 90; 90
2410.5Martin, Kenneth L.; Breton, Gary W.
Computational, ^1^H NMR, and X-ray structural studies on 1-arylurazole tetrazane dimers
Acta Crystallographica Section C, 2017, 73
2020844 CIF
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Paper
C12 H11 Cl N3 O PP 3 c 115.8635; 15.8635; 8.9754
90; 90; 120
1956.06Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Farhadipour, Abolghasem; Ghorbanian, Nazila; Andreev, Pavel V.
A novel tubular hydrogen-bond pattern in a new diazaphosphole oxide: a combination of X-ray crystallography and theoretical study of hydrogen bonds
Acta Crystallographica Section C, 2017, 73, 508-516
2020845 CIF
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Paper
C28 H20 N18 ZnP -18.4211; 9.5379; 9.7491
83.531; 66.048; 85.922
710.78Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020846 CIF
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Paper
C28 H20 Cd N18P -18.7209; 8.7949; 10.349
91.966; 94.945; 112.682
727.67Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020847 CIF
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Paper
C32 H20 Cd N18P -19.271; 9.571; 10.156
87.833; 68.383; 88.803
837.2Setifi, Zouaoui; Zambon, Daniel; Setifi, Fatima; El-Ghozzi, Malika; Mahiou, Rachid; Glidewell, Christopher
Three zinc(II) and cadmium(II) complexes containing 4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole and polynitrile ligands: synthesis, molecular and supramolecular structures, and photoluminescence properties
Acta Crystallographica Section C, 2017, 73
2020848 CIF
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Paper
C78 H91 Fe K N10 O8P 1 21/c 113.0866; 21.934; 24.898
90; 91.214; 90
7145.2Wu, Qi; Yao, Zhen; Li, Jianfeng
Synthesis and characterization of (cryptand-222)potassium (2-methylimidazolato)(<i>meso</i>-tetraphenylporphinato)ferrate(II)‒2-methylimidazole‒tetrahydrofuran (1/1/2)
Acta Crystallographica Section C, 2017, 73
2020849 CIF
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Paper
C20 H18 Cl2 N4 PtP 1 21/c 110.6134; 15.7166; 11.8754
90; 100.376; 90
1948.5DeStefano, Matthew R.; Geiger, David K.
A luminescent bis(pyridyl)-substituted benzimidazole platinum(II) complex exhibiting an intermolecular anagostic interaction
Acta Crystallographica Section C, 2017, 73
2020850 CIF
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Paper
C28 H30 Cl2 Cu N6 O13C 1 2/c 148.675; 8.375; 16.3155
90; 100.716; 90
6535.1Bhat, Satish S.; Revankar, Vidyanand K.; Shivalingegowda, Naveen; Lokanath, N. K.
A fluorophore-labelled copper complex: crystal structure, hybrid cyclic water‒perchlorate cluster and biological properties
Acta Crystallographica Section C, 2017, 73
2020851 CIF
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Paper
C50 H34 Cl2 N4 O14 Zn2P 1 21/n 110.6003; 14.0573; 15.8141
90; 104.016; 90
2286.33Sorenson, Shayne; Popova, Marina; Arif, Atta M.; Berreau, Lisa M.
A bipyridine-ligated zinc(II) complex with bridging flavonolate ligation: synthesis, characterization, and visible-light-induced CO release reactivity
Acta Crystallographica Section C, 2017, 73
2020852 CIF
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Paper
C20 H24 Br4 Cd Hg N2 O5P 1 21/c 17.3985; 16.498; 22.9089
90; 98.3739; 90
2766.5Truong, Khai-Nghi; Merkens, Carina; Englert, Ulli
3-(Pyridin-4-yl)acetylacetone: Cd^II^ and Hg^II^ compete for nitrogen coordination
Acta Crystallographica Section C, 2017, 73
2020853 CIF
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Paper
C21 H25 Cl O5 SP 21 21 215.3945; 9.1577; 43.475
90; 90; 90
2147.7Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
Acta Crystallographica Section C, 2017, 73
2020854 CIF
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Paper
C21 H27 Cl O6 SP 21 21 214.4659; 9.8994; 48.073
90; 90; 90
2125.3Gelbrich, Thomas; Adamer, Verena; Stefinovic, Marijan; Thaler, Andrea; Griesser, Ulrich J.
Hydrogen-bonded structures and interaction energies in two forms of the SGLT-2 inhibitor sotagliflozin
Acta Crystallographica Section C, 2017, 73
2020855 CIF
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Paper
C25 H28 Fe N4 O5P 1 21/n 110.3583; 13.1393; 17.7722
90; 92.291; 90
2416.88Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc
Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1)
Acta Crystallographica Section C, 2017, 73
2020856 CIF
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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
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 602
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
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 602
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
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 602
2020878 CIF
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Paper
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
Acta Crystallographica Section C, 2018, 74
2020879 CIF
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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)
Acta Crystallographica Section C, 2018, 74

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