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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2108294 | CIF | C13 H11 N3 O2 | P 1 21/c 1 | 8.4553; 10.1812; 13.408 90; 98.646; 90 | 1141.1 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108295 | CIF | C13 H13 N3 O3 | P b c a | 7.0488; 12.15; 28.649 90; 90; 90 | 2453.6 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108296 | CIF Paper | C13 H10 I N3 O | P -1 | 10.0223; 11.1984; 12.4505 109.836; 101.25; 97.494 | 1259.58 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108297 | CIF | C15 H11 I N4 | I 41 | 15.0197; 15.0197; 12.8791 90; 90; 90 | 2905.41 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108298 | CIF | C15 H11 Br N4 | P 1 21/c 1 | 14.8761; 4.0269; 23.183 90; 105.81; 90 | 1336.23 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108299 | CIF | C16 H14 Cl2 N4 O | P 1 21/c 1 | 9.51859; 15.70955; 21.6869 90; 98.0651; 90 | 3210.83 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108300 | CIF | C13 H10 Br N3 O | P 1 21/c 1 | 18.763; 6.5126; 10.1237 90; 95.458; 90 | 1231.5 | Berger, Gilles; Soubhye, Jalal; Wintjens, René; Robeyns, Koen; Meyer, Franck Crystal packing and theoretical analysis of halogen- and hydrogen-bonded hydrazones from pharmaceuticals. Evidence of type I and II halogen bonds in extended chains of dichloromethane Acta Crystallographica Section B, 2018, 74 |
| 2108301 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/c 1 | 4.7568; 19.9611; 13.4063 90; 98.457; 90 | 1259.1 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108302 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/n 1 | 4.808; 9.7371; 27.708 90; 91.735; 90 | 1296.6 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108303 | CIF HKL Paper | C14 H9 Cl F3 N O | P -1 | 4.8189; 9.4501; 14.0283 96.048; 93.4; 93.414 | 632.77 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108304 | CIF HKL Paper | C14 H9 Cl F3 N O | P c a 21 | 7.7658; 19.1333; 8.8369 90; 90; 90 | 1313.03 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108305 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/c 1 | 25.6147; 5.3354; 9.3918 90; 96.775; 90 | 1274.56 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108306 | CIF HKL Paper | C14 H9 Cl F3 N O | P -1 | 5.1563; 10.7617; 11.9075 99.948; 91.911; 102.379 | 633.98 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108307 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/c 1 | 9.445; 15.275; 18.954 90; 97.374; 90 | 2711.9 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108308 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/c 1 | 12.8325; 10.3856; 9.7379 90; 93.059; 90 | 1295.95 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108309 | CIF HKL Paper | C14 H9 Cl F3 N O | P 1 21/c 1 | 16.952; 5.2521; 28.76 90; 94.966; 90 | 2551 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108310 | CIF HKL Paper | C14 H9 Br F3 N O | P 1 21/n 1 | 4.7992; 10.0208; 27.428 90; 91.755; 90 | 1318.44 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108311 | CIF HKL Paper | C14 H9 Br F3 N O | P 1 21/n 1 | 4.8056; 27.8678; 9.8421 90; 94.227; 90 | 1314.48 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108312 | CIF HKL Paper | C14 H9 Br F3 N O | P c a 21 | 7.8062; 19.3; 8.8433 90; 90; 90 | 1332.33 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108313 | CIF HKL Paper | C14 H9 Br F3 N O | P 1 21 1 | 4.8588; 4.9939; 26.0286 90; 91.448; 90 | 631.37 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108314 | CIF HKL Paper | C14 H9 Br F3 N O | P 1 21/c 1 | 13.018; 10.488; 9.7309 90; 94.432; 90 | 1324.6 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108315 | CIF HKL Paper | C14 H9 Br F3 N O | P 1 21/c 1 | 16.9434; 5.2417; 29.141 90; 94.775; 90 | 2579.09 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108316 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 20.7974; 6.5752; 9.6889 90; 93.899; 90 | 1321.86 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108317 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 11.0022; 4.7359; 26.562 90; 97.636; 90 | 1371.7 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108318 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 20.584; 7.1797; 9.1451 90; 97.122; 90 | 1341.1 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108319 | CIF HKL Paper | C14 H9 F3 I N O | P c a 21 | 7.9499; 19.6384; 8.8397 90; 90; 90 | 1380.08 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108320 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 26.9793; 5.2899; 9.5068 90; 95.747; 90 | 1349.97 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108321 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21 1 | 4.9085; 4.9644; 26.7593 90; 92.549; 90 | 651.42 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108322 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 13.292; 10.708; 9.762 90; 96.305; 90 | 1381 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108323 | CIF HKL Paper | C14 H9 F3 I N O | P 1 21/c 1 | 14.7689; 5.2518; 17.2537 90; 93.217; 90 | 1336.1 | Mondal, Pradip Kumar; Shukla, Rahul; Biswas, Subha; Chopra, Deepak Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF~3~ and halogen (Cl or Br or I) substituted benzamides Acta Crystallographica Section B, 2018, 74 |
| 2108324 | CIF HKL | C24 H22 Cl N9 O5 S | P -1 | 7.522; 8.11; 20.892 92.574; 98.836; 103.844 | 1218.3 | Peng, Bo; Wang, Jian-Rong; Mei, Xuefeng Triamterene–furosemide salt: structural aspects and physicochemical evaluation Acta Crystallographica Section B, 2018, 74 |
| 2108325 | CIF | Ba F2.8 Li O0.1 | P m -3 m | 3.9978; 3.9978; 3.9978 90; 90; 90 | 63.894 | Wiedemann, Dennis; Meutzner, Falk; Fabelo, Oscar; Ganschow, Steffen The inverse perovskite BaLiF~3~: single-crystal neutron diffraction and analyses of potential ion pathways Acta Crystallographica Section B, 2018, 74 |
| 2108326 | CIF | Ba F2.8 Li O0.1 | P m -3 m | 4.0406; 4.0406; 4.0406 90; 90; 90 | 65.969 | Wiedemann, Dennis; Meutzner, Falk; Fabelo, Oscar; Ganschow, Steffen The inverse perovskite BaLiF~3~: single-crystal neutron diffraction and analyses of potential ion pathways Acta Crystallographica Section B, 2018, 74 |
| 2108327 | CIF | Ba F2.8 Li O0.1 | P m -3 m | 4.0581; 4.0581; 4.0581 90; 90; 90 | 66.83 | Wiedemann, Dennis; Meutzner, Falk; Fabelo, Oscar; Ganschow, Steffen The inverse perovskite BaLiF~3~: single-crystal neutron diffraction and analyses of potential ion pathways Acta Crystallographica Section B, 2018, 74 |
| 2108328 | CIF | Ba F2.8 Li O0.1 | P m -3 m | 4.0763; 4.0763; 4.0763 90; 90; 90 | 67.733 | Wiedemann, Dennis; Meutzner, Falk; Fabelo, Oscar; Ganschow, Steffen The inverse perovskite BaLiF~3~: single-crystal neutron diffraction and analyses of potential ion pathways Acta Crystallographica Section B, 2018, 74 |
| 2108329 | CIF | Ba F2.8 Li O0.1 | P m -3 m | 3.997; 3.997; 3.997 90; 90; 90 | 63.86 | Wiedemann, Dennis; Meutzner, Falk; Fabelo, Oscar; Ganschow, Steffen The inverse perovskite BaLiF~3~: single-crystal neutron diffraction and analyses of potential ion pathways Acta Crystallographica Section B, 2018, 74 |
| 2108330 | CIF | C8 H16 Cu2 O10 | C 1 2/c 1 | 13.08438; 8.50319; 14.05022 90; 119.309; 90 | 1363.12 | Herich, Peter; Bučinský, Lukáš; Breza, Martin; Gall, Marián; Fronc, Marek; Petřiček, Václav; Kožíšek, Jozef Electronic structure of two isostructural `paddle-wheel' complexes: a comparative study Acta Crystallographica Section B, 2018, 74 |
| 2108331 | CIF | C8 H16 Cr2 O10 | C 1 2/c 1 | 13.10149; 8.56324; 14.14837 90; 119.121; 90 | 1386.68 | Herich, Peter; Bučinský, Lukáš; Breza, Martin; Gall, Marián; Fronc, Marek; Petřiček, Václav; Kožíšek, Jozef Electronic structure of two isostructural `paddle-wheel' complexes: a comparative study Acta Crystallographica Section B, 2018, 74 |
| 2108332 | CIF HKL | H0 Na2 O14 Si4 V | P 1 21 1 | 14.3328; 9.1209; 10.3732 90; 90.007; 90 | 1356.07 | Danisi, Rosa Micaela; Armbruster, Thomas Dehydration of microporous vanadosilicates: the case of VSH-13Na Acta Crystallographica Section B, 2018, 74, 483-491 |
| 2108333 | CIF | H0 Na2 O14 Si4 V | P 1 21 1 | 14.364; 9.134; 10.373 90; 90.056; 90 | 1360.9 | Danisi, Rosa Micaela; Armbruster, Thomas Dehydration of microporous vanadosilicates: the case of VSH-13Na Acta Crystallographica Section B, 2018, 74, 483-491 |
| 2108334 | CIF | H0 Na2 O11 Si4 V | P 1 21 1 | 12.584; 9.525; 9.696 90; 90.1; 90 | 1162 | Danisi, Rosa Micaela; Armbruster, Thomas Dehydration of microporous vanadosilicates: the case of VSH-13Na Acta Crystallographica Section B, 2018, 74, 483-491 |
| 2108335 | CIF HKL | C14 H12 N2 O2 | P b c a | 14.5448; 6.5214; 23.8246 90; 90; 90 | 2259.82 | Kutniewska, Sylwia E.; Jarzembska, Katarzyna N.; Kamiński, Radosław; Stasyuk, Anton J.; Gryko, Daniel T.; Cyrański, Michał K. Structural, energetic and spectroscopic studies of new luminescent complexes based on 2-(2'-hydroxyphenyl)imidazo[1,2-<i>a</i>]pyridines and 1,2-phenylenediboronic acid Acta Crystallographica Section B, 2018, 74, 725-737 |
| 2108336 | CIF HKL | C13 H9 Br N2 O | P 1 21/c 1 | 12.8423; 7.0971; 12.6239 90; 107.188; 90 | 1099.19 | Kutniewska, Sylwia E.; Jarzembska, Katarzyna N.; Kamiński, Radosław; Stasyuk, Anton J.; Gryko, Daniel T.; Cyrański, Michał K. Structural, energetic and spectroscopic studies of new luminescent complexes based on 2-(2'-hydroxyphenyl)imidazo[1,2-<i>a</i>]pyridines and 1,2-phenylenediboronic acid Acta Crystallographica Section B, 2018, 74, 725-737 |
| 2108337 | CIF HKL | C22 H20 B2 N2 O4 | P 1 21 1 | 10.7147; 34.282; 10.9168 90; 93.176; 90 | 4003.8 | Kutniewska, Sylwia E.; Jarzembska, Katarzyna N.; Kamiński, Radosław; Stasyuk, Anton J.; Gryko, Daniel T.; Cyrański, Michał K. Structural, energetic and spectroscopic studies of new luminescent complexes based on 2-(2'-hydroxyphenyl)imidazo[1,2-<i>a</i>]pyridines and 1,2-phenylenediboronic acid Acta Crystallographica Section B, 2018, 74, 725-737 |
| 2108338 | CIF HKL | C43 H38 B4 N4 O9 | C 1 2/c 1 | 21.8035; 10.4647; 19.3032 90; 111.794; 90 | 4089.6 | Kutniewska, Sylwia E.; Jarzembska, Katarzyna N.; Kamiński, Radosław; Stasyuk, Anton J.; Gryko, Daniel T.; Cyrański, Michał K. Structural, energetic and spectroscopic studies of new luminescent complexes based on 2-(2'-hydroxyphenyl)imidazo[1,2-<i>a</i>]pyridines and 1,2-phenylenediboronic acid Acta Crystallographica Section B, 2018, 74, 725-737 |
| 2108339 | CIF HKL | C19 H13 B2 Br N2 O3 | P -1 | 8.9492; 14.5926; 15.0762 66.778; 82.477; 86.204 | 1793.5 | Kutniewska, Sylwia E.; Jarzembska, Katarzyna N.; Kamiński, Radosław; Stasyuk, Anton J.; Gryko, Daniel T.; Cyrański, Michał K. Structural, energetic and spectroscopic studies of new luminescent complexes based on 2-(2'-hydroxyphenyl)imidazo[1,2-<i>a</i>]pyridines and 1,2-phenylenediboronic acid Acta Crystallographica Section B, 2018, 74, 725-737 |
| 2108340 | CIF HKL Paper | Br2 Cu O6 Pb2 Se2 | P 1 21/n 1 | 6.9097; 5.5036; 24.8544 90; 93.808; 90 | 943.08 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108341 | CIF HKL | Br6 Cu O12 Pb6 Se4 | P 1 21/c 1 | 11.154; 12.95; 19.834 90; 123.74; 90 | 2382 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108342 | CIF HKL | Br0.67 Cu0.67 O2 Pb0.33 Se0.67 | C m c m | 8.275; 9.303; 11.891 90; 90; 90 | 915.4 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108343 | CIF HKL | Br Cu2 O6 Pb0.5 Se2 | C 1 2/c 1 | 19.434; 8.542; 9.039 90; 100.684; 90 | 1474.5 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108344 | CIF HKL | Br0.4 Cu1.5 O7.5 Pb1.2 Se2.5 | C 1 2/m 1 | 19.502; 5.2408; 16.469 90; 102.769; 90 | 1641.6 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108345 | CIF HKL | Br1.75 Cu2.5 O4 Pb0.5 Se | C 1 2/m 1 | 19.049; 6.226; 12.726 90; 109.843; 90 | 1419.7 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108346 | CIF HKL | Br1.17 Cu1.92 O3 Pb0.25 Se0.75 | C 1 2/m 1 | 19.146; 6.2686; 17.296 90; 99.27; 90 | 2048.7 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108347 | CIF HKL | Br1.83 Cu3.17 O5.33 Pb0.67 Se1.33 | C 1 2/m 1 | 38.0763; 6.2308; 11.1897 90; 94.955; 90 | 2644.8 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108348 | CIF HKL | Br22.16 Cu28 O64 Pb17.06 Se16 | C m m m | 23.943; 20.268; 6.313 90; 90; 90 | 3064 | Siidra, Oleg I.; Kozin, Michael S.; Depmeier, Wulf; Kayukov, Roman A.; Kovrugin, Vadim M. Copper‒lead selenite bromides: a new large family of compounds partly having Cu^2+^ substructures derivable from kagome nets Acta Crystallographica Section B, 2018, 74, 712-724 |
| 2108349 | CIF HKL | C0.919 Ba2 Ca17.621 F3.462 Na0.379 O39.7 P2.96 Si6 | R -3 m :H | 7.1255; 7.1255; 66.2902 90; 90; 120 | 2914.81 | Krüger, Biljana; Krüger, Hannes; Galuskin, Evgeny V.; Galuskina, Irina O.; Vapnik, Yevgeny; Olieric, Vincent; Pauluhn, Anuschka Aravaite, Ba~2~Ca~18~(SiO~4~)~6~(PO~4~)~3~(CO~3~)F~3~O: modular structure and disorder of a new mineral with single and triple antiperovskite layers Acta Crystallographica Section B, 2018, 74, 492-501 |
| 2108350 | CIF HKL Paper | F7 H12 N3 Ti | P a -3 | 11.78316; 11.78316; 11.78316 90; 90; 90 | 1636.01 | Molokeev, Maxim; Misjul, Sergey V.; Flerov, Igor N.; Laptash, Natalia M. Reconstructive phase transition in (NH~4~)~3~TiF~7~ accompained by the ordering TiF~6~ of octahera Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 924-931 |
| 2108351 | CIF Paper | C4 H12 Al N | P 1 21/c 1 | 7.40203; 12.96634; 7.28776 90; 90.6602; 90 | 699.41 | Bernert, Thomas; Ley, Morten Brix; Ruiz-Fuertes, Javier; Fischer, Michael; Felderhoff, Michael; Weidenthaler, Claudia Title (type here to add) Acta Crystallographica, Section B, 2016, 72, 232-240 |
| 2108352 | CIF HKL Paper | Ca5 Cl0.9 F0.1 O12 P3 | P 63/m | 9.502; 9.502; 6.8356 90; 90; 120 | 534.5 | Christoph, Staehli; Thuering, Juerg; Galea, Laetitia; Tadier, Solene; Bohner, Marc; Doebelin, Nicola Hydrogen-substituted beta-tricalcium phosphate synthesized in organic media Acta Crystallographica, Section B, 2016, 72, 875-884 |
| 2108353 | CIF | C38 H42 N8 Se6 | P -1 | 9.797; 10.56; 10.656 87.528; 69.844; 87.528 | 1033.5 | Riel, Asia Marie S.; Jeannin, Olivier; Berryman, Orion B.; Fourmigué, Marc Co-crystals of an organic triselenocyanate with ditopic Lewis bases: recurrent chalcogen bond interactions motifs Acta Crystallographica Section B, 2019, 75, 34-38 |
| 2108354 | CIF | C36 H34 N6 O2 Se6 | P -1 | 10.008; 10.4345; 10.76 93.538; 117.528; 95.282 | 985.3 | Riel, Asia Marie S.; Jeannin, Olivier; Berryman, Orion B.; Fourmigué, Marc Co-crystals of an organic triselenocyanate with ditopic Lewis bases: recurrent chalcogen bond interactions motifs Acta Crystallographica Section B, 2019, 75, 34-38 |
| 2108355 | CIF | C36 H34 N8 O4 Se6 | P -1 | 10.187; 10.415; 11.232 75.891; 82.213; 61.753 | 1017.8 | Riel, Asia Marie S.; Jeannin, Olivier; Berryman, Orion B.; Fourmigué, Marc Co-crystals of an organic triselenocyanate with ditopic Lewis bases: recurrent chalcogen bond interactions motifs Acta Crystallographica Section B, 2019, 75, 34-38 |
| 2108356 | CIF HKL | Al72 Au2.5 Ir29.5 | I 41/a c d | 8.6339; 8.6339; 21.8874 90; 90; 90 | 1631.58 | Kadok, Joris; de Weerd, Marie-Cécile; Boulet, Pascal; Fournée, Vincent; Ledieu, Julian A new ternary compound with the BGa~8~Ir~4~ structure type in the Al‒Au‒Ir system Acta Crystallographica Section B, 2019, 75, 49-52 |
| 2108357 | CIF | C6 H3 Cu F N4 O2 | P 21 21 21 | 6.6235; 9.4208; 12.5188 90; 90; 90 | 781.16 | Ming, Mei; Shi, Jun Solvent-mediated structural transformations of copper(II) coordination polymers induced by different short-chain alcohols Acta Crystallographica Section B, 2019, 75 |
| 2108358 | CIF HKL | C26 H20 Cu3 F4 N10 O10 | P 1 21/n 1 | 10.441; 8.058; 19.542 90; 95.92; 90 | 1635.4 | Ming, Mei; Shi, Jun Solvent-mediated structural transformations of copper(II) coordination polymers induced by different short-chain alcohols Acta Crystallographica Section B, 2019, 75 |
| 2108359 | CIF HKL | C28 H24 Cu3 F4 N10 O10 | P 1 21/n 1 | 10.3405; 8.6279; 19.594 90; 98.153; 90 | 1730.4 | Ming, Mei; Shi, Jun Solvent-mediated structural transformations of copper(II) coordination polymers induced by different short-chain alcohols Acta Crystallographica Section B, 2019, 75 |
| 2108360 | CIF HKL | C38 H24 Cu5 F6 N18 O14 | P -1 | 7.2091; 12.3296; 13.5573 99.68; 101.459; 90.199 | 1163.4 | Ming, Mei; Shi, Jun Solvent-mediated structural transformations of copper(II) coordination polymers induced by different short-chain alcohols Acta Crystallographica Section B, 2019, 75 |
| 2108361 | CIF HKL | C16 H22 N10 O10 | P -1 | 6.7486; 10.5419; 15.658 81.293; 79.732; 79.974 | 1071.02 | Gryl, Marlena; Kozieł, Marcin; Stadnicka, Katarzyna M. A proposal for coherent nomenclature of multicomponent crystals Acta Crystallographica Section B, 2019, 75 |
| 2108362 | CIF HKL | C17 H10 N2 | P 1 21/c 1 | 4.064; 16.58; 17.57 90; 91.53; 90 | 1183 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108363 | CIF HKL | C17 H10 N2 | P c c n | 4.1239; 16.404; 17.252 90; 90; 90 | 1167.1 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108364 | CIF HKL | C17 H10 N2 | P c a 21 | 7.394; 10.953; 29.06 90; 90; 90 | 2353 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108365 | CIF HKL | C17 H10 N2 | P 1 21/a 1 | 8.2204; 10.898; 26.905 90; 98.691; 90 | 2382.6 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108366 | CIF HKL | C16 H9 N3 | P m n 21 | 19.316; 3.7013; 7.7676 90; 90; 90 | 555.3 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108367 | CIF HKL | C16 H9 N3 | P 1 21/c 1 | 4.0049; 16.518; 17.179 90; 90.007; 90 | 1136.4 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108368 | CIF HKL | C16 H9 N3 | P c c n | 4.0741; 16.416; 17.23 90; 90; 90 | 1152.3 | Kader, Thomas; Stöger, Berthold; Fröhlich, Johannes; Kautny, Paul The phase transitions of 4-aminopyridine-based indolocarbazoles: twinning, local- and pseudo-symmetry Acta Crystallographica Section B, 2019, 75, 97-106 |
| 2108369 | CIF HKL | H4 N2 O3 W | P 32 2 1 | 5.79842; 5.79842; 9.2341 90; 90; 120 | 268.871 | Giovannelli, F.; Mathieu, C.; Fritsch, K.; Adil, K.; Goutenoire, F.; Habicht, K.; Delorme, F. Room-temperature synthesis of a new stable (N~2~H~4~)WO~3~ compound: a route for hydrazine trapping Acta Crystallographica Section B, 2019, 75 |
| 2108370 | CIF HKL Paper | C10 H17 N O6 | C 1 2 1 | 21.2256; 5.67647; 32.0621 90; 100.17; 90 | 3802.35 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108371 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.2633; 5.67322; 32.053 90; 100.076; 90 | 3807 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108372 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.33; 5.67423; 32.0776 90; 99.937; 90 | 3824.15 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108373 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.3889; 5.67352; 32.0754 90; 99.818; 90 | 3835.4 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108374 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.4563; 5.67251; 32.0779 90; 99.653; 90 | 3849 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108375 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.5229; 5.6692; 32.0754 90; 99.486; 90 | 3860.2 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108376 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.6021; 5.6701; 32.0856 90; 99.299; 90 | 3878.4 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108377 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.6777; 5.665; 32.0878 90; 99.115; 90 | 3890.8 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108378 | CIF HKL | C10 H17 N O6 | C 1 2 1 | 21.7528; 5.6663; 32.0956 90; 98.955; 90 | 3907.8 | Arkhipov, S. G.; Losev, E. A.; Nguyen, T. T.; Rychkov, D. A.; Boldyreva, E. V. A large anisotropic plasticity of <small>L</small>-leucinium hydrogen maleate preserved at cryogenic temperatures Acta Crystallographica Section B, 2019, 75 |
| 2108379 | CIF HKL Paper | Al84 Cu26 Li40 Mg12 | I m -3 | 13.8451; 13.8451; 13.8451 90; 90; 90 | 2653.92 | Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Ehrenberg, Helmut Li~20~Mg~6~Cu~13~Al~42~: a new ordered quaternary superstructure to the icosahedral <i>T</i>-Mg~32~(Zn,Al)~49~ phase with fullerene-like Al~60~ cluster Acta Crystallographica Section B, 2019, 75 |
| 2108380 | CIF HKL | C14 H24 Cl N O | P 1 21 1 | 7.1062; 11.5821; 17.3894 90; 94.9978; 90 | 1425.79 | Gaztañaga, Pablo; Baggio, Ricardo; Halac, Emilia; Vega, Daniel R. Thermal, spectroscopic and structural analysis of a thermosalient phase transformation in tapentadol hydrochloride Acta Crystallographica Section B, 2019, 75 |
| 2108381 | CIF HKL | C14 H24 Cl N O | P 1 21 1 | 7.135; 11.6402; 17.4546 90; 94.7791; 90 | 1444.61 | Gaztañaga, Pablo; Baggio, Ricardo; Halac, Emilia; Vega, Daniel R. Thermal, spectroscopic and structural analysis of a thermosalient phase transformation in tapentadol hydrochloride Acta Crystallographica Section B, 2019, 75 |
| 2108382 | CIF HKL | C14 H24 Cl N O | P 21 21 21 | 7.0653; 11.8351; 17.6593 90; 90; 90 | 1476.64 | Gaztañaga, Pablo; Baggio, Ricardo; Halac, Emilia; Vega, Daniel R. Thermal, spectroscopic and structural analysis of a thermosalient phase transformation in tapentadol hydrochloride Acta Crystallographica Section B, 2019, 75 |
| 2108383 | CIF HKL | C15 H12 O9.5 | C 1 2 1 | 23.2416; 5.2305; 25.4061 90; 102.634; 90 | 3013.7 | Terekhov, Roman P.; Selivanova, Irina A.; Tyukavkina, Nonna A.; Shylov, Genadiy V.; Utenishev, Andrey N.; Porozov, Yuri B. Taxifolin tubes: crystal engineering and characteristics Acta Crystallographica Section B, 2019, 75 |
| 2108384 | CIF Paper | C40 H50 N2 O12 | P 1 21/c 1 | 12.078; 30.555; 10.2038 90; 107.272; 90 | 3595.8 | Shishkina, Svitlana V.; Isaiev, Ivan A.; Urzhuntseva, Viktoriya V.; Palchykov, Vitalii A. The formation of the salt and neutral molecule cocrystal from equimolar solution of heliamine and bicyclo[2.2.1]hept-5-ene-<i>endo</i>-2,3-dicarboxylic acid Acta Crystallographica Section B, 2019, 75 |
| 2108385 | CIF HKL | C26 H26 N4 O4 | C 1 2 1 | 23.479; 8.602; 16.899 90; 129.963; 90 | 2615.9 | Han, Yang; Fu, Qiang; Zhang, Peng; Guan, Hongyu; Guo, Fang Acid‒ammonium heterodimer and N~(ammonium)~‒H···N~(pyridine)~ synthon preference in three salts of nicotinic acid with (1<i>R</i>,2<i>R</i>)-1,2-diphenylethylenediamine Acta Crystallographica Section B, 2019, 75 |
| 2108386 | CIF HKL | C30 H34 N4 O6 | C 1 2 1 | 22.9673; 8.8676; 16.7749 90; 118.613; 90 | 2999.2 | Han, Yang; Fu, Qiang; Zhang, Peng; Guan, Hongyu; Guo, Fang Acid–ammonium heterodimer and N~(ammonium)~–H···N~(pyridine)~ synthon preference in three salts of nicotinic acid with (1<i>R</i>,2<i>R</i>)-1,2-diphenylethylenediamine Acta Crystallographica Section B, 2019, 75 |
| 2108387 | CIF HKL | C28 H29 N5 O4 | P 21 21 21 | 11.77; 14.079; 16.502 90; 90; 90 | 2735 | Han, Yang; Fu, Qiang; Zhang, Peng; Guan, Hongyu; Guo, Fang Acid–ammonium heterodimer and N~(ammonium)~–H···N~(pyridine)~ synthon preference in three salts of nicotinic acid with (1<i>R</i>,2<i>R</i>)-1,2-diphenylethylenediamine Acta Crystallographica Section B, 2019, 75 |
| 2108388 | CIF HKL | C26 H26 N4 O4 | P 65 2 2 | 13.854; 13.854; 27.167 90; 90; 120 | 4515.7 | Han, Yang; Fu, Qiang; Zhang, Peng; Guan, Hongyu; Guo, Fang Acid‒ammonium heterodimer and N~(ammonium)~‒H···N~(pyridine)~ synthon preference in three salts of nicotinic acid with (1<i>R</i>,2<i>R</i>)-1,2-diphenylethylenediamine Acta Crystallographica Section B, 2019, 75 |
| 2108389 | CIF HKL | C12 H24 I2 O12 Sr | P 1 21 1 | 7.8592; 12.9355; 9.9504 90; 92.803; 90 | 1010.37 | Marabello, Domenica; Antoniotti, Paola; Benzi, Paola; Cariati, Elena; Lo Presti, Leonardo; Canepa, Carlo Developing new SrI~2~ and β-<small>D</small>-fructopyranose-based metal‒organic frameworks with nonlinear optical properties Acta Crystallographica Section B, 2019, 75 |
| 2108390 | CIF HKL | C36 H86 I8 O43 Sr4 | P 21 21 21 | 12.3717; 17.4352; 17.6607 90; 90; 90 | 3809.47 | Marabello, Domenica; Antoniotti, Paola; Benzi, Paola; Cariati, Elena; Lo Presti, Leonardo; Canepa, Carlo Developing new SrI~2~ and β-<small>D</small>-fructopyranose-based metal–organic frameworks with nonlinear optical properties Acta Crystallographica Section B, 2019, 75 |
| 2108391 | CIF HKL | C6 H18 I2 O9 Sr | P 21 21 21 | 9.1192; 13.0908; 13.5504 90; 90; 90 | 1617.61 | Marabello, Domenica; Antoniotti, Paola; Benzi, Paola; Cariati, Elena; Lo Presti, Leonardo; Canepa, Carlo Developing new SrI~2~ and β-<small>D</small>-fructopyranose-based metal‒organic frameworks with nonlinear optical properties Acta Crystallographica Section B, 2019, 75 |
| 2108392 | CIF | Ge Te | P n m a | 7.369; 3.9249; 5.698 90; 90; 90 | 164.8 | Herrmann, Markus Guido; Stoffel, Ralf Peter; Küpers, Michael; Ait Haddouch, Mohammed; Eich, Andreas; Glazyrin, Konstantin; Grzechnik, Andrzej; Dronskowski, Richard; Friese, Karen New insights on the GeSe<i>~{ıt x~</i>}Te~1{-~<i>x</i>} phase diagram from theory and experiment Acta Crystallographica Section B, 2019, 75 |
| 2108393 | CIF HKL | C7 H11 F Ge3.84 N2 O24 Si8.16 | I m m a | 14.9725; 5.2733; 17.0318 90; 90; 90 | 1344.7 | Wang, Xiaoge; Shen, Yihan; Liu, Rongli; Liu, Xiaolong; Lin, Cong; Shi, Dier; Chen, Yanping; Liao, Fuhui; Lin, Jianhua; Sun, Junliang Elucidation of correlated disorder in zeolite IM-18 Acta Crystallographica Section B, 2019, 75 |
| 2108394 | CIF HKL | C17 H10 O | P -1 | 6.92715; 8.3336; 10.4706 109.898; 98.979; 100.773 | 542.32 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108395 | CIF HKL | C17 H10 O | P -1 | 6.7049; 8.1989; 10.329 109.691; 99.378; 100.628 | 509.66 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108396 | CIF HKL | C17 H10 O | P -1 | 6.695; 8.1846; 10.306 109.649; 99.384; 100.652 | 506.97 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108397 | CIF HKL | C17 H10 O | P -1 | 6.6139; 8.1151; 10.272 109.439; 99.563; 100.637 | 495.3 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108398 | CIF HKL | C17 H10 O | P -1 | 6.6007; 8.1331; 10.232 109.52; 99.88; 100.617 | 492.5 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108399 | CIF HKL | C17 H10 O | P -1 | 6.477; 8.041; 10.205 109.37; 99.57; 100.71 | 477.6 | Tchoń, Daniel; Makal, Anna Structure and piezochromism of pyrene-1-carbaldehyde at high pressure Acta Crystallographica Section B, 2019, 75 |
| 2108400 | CIF HKL | C26 H12 N4 O2 | P 1 21/c 1 | 13.119; 4.777; 27.3921 90; 95.8533; 90 | 1707.7 | Zherebtsov, D. A.; Schmidt, M. U.; Niewa, R.; Sakthidharan, C. P.; Podgornov, F. V.; Matveychuk, Y. V.; Nayfert, S. A.; Polozov, M. A.; Ivashevskaya, S. N.; Stash, A. I.; Chen, Yu-Sheng; Zhivulin, D. E.; Zhivulin, V. E.; Merzlov, S. V.; Bartashevich, E. V.; Avdin, V. V.; Hsu, Hua Shu; Guo, Feng Wei Two new polymorphs of <i>cis</i>-perinone: crystal structures, physical and electric properties Acta Crystallographica Section B, 2019, 75 |
| 2108401 | CIF HKL | C26 H12 N4 O2 | P 1 21/c 1 | 16.971; 7.3707; 14.0809 90; 94.09; 90 | 1756.9 | Zherebtsov, D. A.; Schmidt, M. U.; Niewa, R.; Sakthidharan, C. P.; Podgornov, F. V.; Matveychuk, Y. V.; Nayfert, S. A.; Polozov, M. A.; Ivashevskaya, S. N.; Stash, A. I.; Chen, Yu-Sheng; Zhivulin, D. E.; Zhivulin, V. E.; Merzlov, S. V.; Bartashevich, E. V.; Avdin, V. V.; Hsu, Hua Shu; Guo, Feng Wei Two new polymorphs of <i>cis</i>-perinone: crystal structures, physical and electric properties Acta Crystallographica Section B, 2019, 75 |
| 2108402 | CIF HKL | C24 H22 Cl2 N2 O2 | I 1 2/a 1 | 18.1075; 14.16642; 18.5436 90; 117.163; 90 | 4232.16 | So, Hee-Soo; Matsumoto, Shinya Three differently coloured polymorphs of 3,6-bis(4-chlorophenyl)-2,5-dipropyl-2,5-dihydropyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 2019, 75 |
| 2108403 | CIF HKL | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108404 | CIF HKL | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108405 | CIF | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108406 | CIF HKL | C26 H19 P S | P -1 | 10.227; 12.324; 17.353 101.55; 91.23; 112.04 | 1975 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108407 | CIF HKL | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108408 | CIF HKL | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108409 | CIF HKL | C26 H19 P S | P -1 | 10.223; 12.326; 17.357 101.55; 91.23; 112.05 | 1974.8 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108410 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108411 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108412 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108413 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108414 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108415 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108416 | CIF HKL | C52 H44 P2 S2 | P 1 21/n 1 | 10.7687; 14.7934; 13.4133 90; 103.813; 90 | 2075.02 | Köhler, Christian; Lübben, Jens; Krause, Lennard; Hoffmann, Christina; Herbst-Irmer, Regine; Stalke, Dietmar Comparison of different strategies for modelling hydrogen atoms in charge density analyses Acta Crystallographica Section B, 2019, 75 |
| 2108417 | CIF HKL | C6 H16 N2 O6 | P 1 21/c 1 | 10.1517; 11.96; 8.9955 90; 114.322; 90 | 995.25 | Gomathi, V.; Theivarasu, C. Supramolecular networks and Hirshfeld surfaces of oxydiacetic acid and iminodiacetic acid salts Acta Crystallographica Section B, 2019, 75, 449-458 |
| 2108418 | CIF HKL | C10 H14 N2 O5 | P 1 21/n 1 | 8.3828; 23.9943; 17.2844 90; 98.635; 90 | 3437.2 | Gomathi, V.; Theivarasu, C. Supramolecular networks and Hirshfeld surfaces of oxydiacetic acid and iminodiacetic acid salts Acta Crystallographica Section B, 2019, 75, 449-458 |
| 2108419 | CIF HKL | C10 H22 N4 O8 | P 1 21/n 1 | 5.1027; 16.024; 8.7273 90; 94.459; 90 | 711.43 | Gomathi, V.; Theivarasu, C. Supramolecular networks and Hirshfeld surfaces of oxydiacetic acid and iminodiacetic acid salts Acta Crystallographica Section B, 2019, 75, 449-458 |
| 2108420 | CIF HKL | C18 H16 Cl2 Co N4 | P c a 21 | 14.8764; 8.9742; 26.8271 90; 90; 90 | 3581.5 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108421 | CIF HKL | C18 H16 Co I2 N4 | C 1 2/c 1 | 7.5817; 18.625; 14.2346 90; 100.448; 90 | 1976.7 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108422 | CIF HKL | C18 H16 Co N6 O6 | P 1 21/c 1 | 9.4982; 14.9627; 14.5081 90; 107.938; 90 | 1961.6 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108423 | CIF HKL | C20 H16 Co N6 S2 | I 1 2/a 1 | 17.5108; 13.8088; 18.915 90; 114.745; 90 | 4153.7 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108424 | CIF HKL | C38 H37 Co I2 N9 O | P n n 2 | 11.355; 12.68; 13.4516 90; 90; 90 | 1936.8 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108425 | CIF HKL | C38 H37 Co N11 O7 | P n n 2 | 11.3655; 12.5153; 13.6247 90; 90; 90 | 1938.01 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108426 | CIF HKL | C40 H40 Co N10 O2 S2 | P -1 | 8.6822; 9.457; 13.6578 103.023; 95.901; 107.217 | 1026.15 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108427 | CIF HKL | C20 H16 Co N6 S2 | C 1 2/c 1 | 24.4747; 5.5932; 14.8644 90; 94.172; 90 | 2029.4 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108428 | CIF | C149 N30 O78 S6 | P 21 21 21 | 18.5453; 30.1766; 39.798 90; 90; 90 | 22272 | Fili, Stavroula; Valmas, Alexandros; Spiliopoulou, Maria; Kontou, Paraskevi; Fitch, Andrew; Beckers, Detlef; Degen, Thomas; Barlos, Kleomenis; Barlos, Kostas K.; Karavassili, Fotini; Margiolaki, Irene Revisiting the structure of a synthetic somatostatin analogue for peptide drug design Acta Crystallographica Section B, 2019, 75 |
| 2108429 | CIF HKL | C5 H7 Cl4 N2 Sb | C 1 2/c 1 | 13.4747; 12.9393; 7.7611 90; 123.733; 90 | 1125.34 | Gagor, Anna Phase transitions in ferroelectric 4-aminopyridinium tetrachloroantimonate(III) ‒ revisited Acta Crystallographica Section B, 2018, 74, 217-225 |
| 2108430 | CIF HKL | C5 H7 Cl4 N2 Sb | C 1 2/c 1 | 13.3923; 12.815; 7.8256 90; 123.735; 90 | 1116.9 | Gagor, Anna Phase transitions in ferroelectric 4-aminopyridinium tetrachloroantimonate(III) ‒ revisited Acta Crystallographica Section B, 2018, 74, 217-225 |
| 2108431 | CIF HKL | C5 H7 Cl4 N2 Sb | C 1 c 1 | 13.33; 12.69; 7.87 90; 123.8; 90 | 1106 | Gagor, Anna Phase transitions in ferroelectric 4-aminopyridinium tetrachloroantimonate(III) ‒ revisited Acta Crystallographica Section B, 2018, 74, 217-225 |
| 2108432 | CIF HKL | C5 H7 Cl4 N2 Sb | C 1 c 1 | 13.3; 12.66; 7.89 90; 123.8; 90 | 1104 | Gagor, Anna Phase transitions in ferroelectric 4-aminopyridinium tetrachloroantimonate(III) ‒ revisited Acta Crystallographica Section B, 2018, 74, 217-225 |
| 2108433 | CIF HKL | C5 H7 Cl4 N2 Sb | P 1 21/n 1 | 13.208; 12.526; 7.9251 90; 123.914; 90 | 1088.1 | Gagor, Anna Phase transitions in ferroelectric 4-aminopyridinium tetrachloroantimonate(III) ‒ revisited Acta Crystallographica Section B, 2018, 74, 217-225 |
| 2108434 | CIF HKL | C2 H6 N4 S | P -1 | 6.9149; 7.0012; 12.3713 90.881; 104.312; 101.783 | 566.74 | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN Acta Crystallographica Section B, 2019, 75 |
| 2108435 | CIF HKL | C10 H16 N18 S | P -1 | 9.8299; 9.8507; 10.2105 64.634; 78.716; 87.703 | 875.04 | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN Acta Crystallographica Section B, 2019, 75 |
| 2108436 | CIF HKL | C6 H9.67 N11 | P 1 21/c 1 | 3.534; 28.13; 10.698 90; 97.025; 90 | 1055.5 | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN Acta Crystallographica Section B, 2019, 75 |
| 2108437 | CIF HKL | C6 H8 N10 | P 1 21/c 1 | 6.032; 7.796; 10.531 90; 105.9; 90 | 476.28 | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN Acta Crystallographica Section B, 2019, 75 |
| 2108438 | CIF HKL | C7 H15 N13 O S | P -1 | 11.1348; 12.1287; 13.1868 63.474; 71.339; 63.549 | 1410.2 | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN Acta Crystallographica Section B, 2019, 75 |
| 2108439 | CIF Paper | Mn13 Na3.98 O26 | C 1 2/m 1 | 22.5199; 2.83987; 14.8815 90; 105.092; 90 | 918.9 | Mugnaioli, Enrico; Gemmi, Mauro; Merlini, Marco; Gregorkiewitz, Miguel (Na,Ω)5[MnO2]13 does not have the romanèchite framework: a new tunnel structure determined and refined by EDT and synchrotron powder diffraction. Acta Crystallographica, Section B, 2016, 72, 893-903 |
| 2108440 | CIF Paper | Mn13 Na3.94 O26 | C 1 2/m 1 | 22.6338; 2.8255; 14.9075 90; 104.599; 90 | 922.58 | Mugnaioli, Enrico; Gemmi, Mauro; Merlini, Marco; Gregorkiewitz, Miguel (Na,Ω)5[MnO2]13 does not have the romanèchite framework: a new tunnel structure determined and refined by EDT and synchrotron powder diffraction. Acta Crystallographica, Section B, 2016, 72, 893-903 |
| 2108441 | CIF HKL Paper | C31 H26 Cl2 N4 O4 | P 1 21/c 1 | 7.47882; 26.0041; 14.78241 90; 102.507; 90 | 2806.66 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108442 | CIF HKL Paper | C31 H28 Cl2 N4 O4 | P -1 | 10.6376; 12.2781; 12.7975 90.079; 113.211; 108.284 | 1443.58 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108443 | CIF HKL Paper | C36.79 H31.18 Cl2 N6.39 O3 S | P -1 | 7.997; 13.5824; 16.6638 80.214; 80.034; 83.036 | 1748.86 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108444 | CIF HKL Paper | C34 H27 Cl2 N5 O3 S | P -1 | 8.2115; 13.5327; 14.325 89.04; 88.864; 83.781 | 1582 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108445 | CIF HKL Paper | C35 H32 Cl2 N4 O5 | P -1 | 9.4861; 12.5322; 15.3641 98.415; 103.379; 110.45 | 1612.41 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108446 | CIF HKL Paper | C35 H28 Cl2 N4 O4 | P -1 | 11.799; 12.0736; 14.6803 72.472; 80.688; 72.03 | 1891.44 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108447 | CIF HKL Paper | C35 H28 Cl2 N4 O4 | P -1 | 10.4028; 10.8454; 15.4229 71.183; 73.984; 76.148 | 1561.33 | Bodart, Laurie; Tumanov, Nikolay; Wouters, Johan Structural variety of clofaziminium salts: effect of the counter-ion on clofaziminium conformation and crystal packing Acta Crystallographica Section B, 2019, 75 |
| 2108448 | CIF HKL | C24 H16 | P 1 21/n 1 | 9.8367; 17.1456; 9.8764 90; 93.73; 90 | 1662.19 | Williams, Alice E.; Thompson, Amber L.; Watkin, David J. The role of multiple observations in small-molecule single-crystal service X-ray structure determination Acta Crystallographica Section B, 2019, 75 |
| 2108449 | CIF HKL Paper | B9 Ba6 Lu5 O27 | C 1 2/c 1 | 13.0927; 9.997; 20.4884 90; 106.827; 90 | 2566.86 | Filatov, Stanislav K.; Biryukov, Yaroslav P.; Bubnova, Rimma S.; Shablinskii, Andrey P. The novel borate Lu~5~Ba~6~B~9~O~27~ with a new structure type: synthesis, disordered crystal structure and negative linear thermal expansion Acta Crystallographica Section B, 2019, 75 |
| 2108450 | CIF | O2 Zr | P 1 21/c 1 | 5.1473; 5.20878; 5.31657 90; 99.2056; 90 | 140.708 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108451 | CIF | O2 Zr | P 1 21/c 1 | 5.14204; 5.20869; 5.30989 90; 99.1726; 90 | 140.398 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108452 | CIF | O2 Zr | P 1 21/c 1 | 5.12418; 5.20803; 5.28293 90; 99.048; 90 | 139.231 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108453 | CIF | O2 Zr | P 1 21/c 1 | 5.10541; 5.20827; 5.25387 90; 98.868; 90 | 138.032 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108454 | CIF | O2 Zr | P 1 21/c 1 | 5.09098; 5.2093; 5.23197 90; 98.706; 90 | 137.155 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108455 | CIF | O2 Zr | P 1 21/c 1 | 5.07006; 5.2095; 5.1975 90; 98.441; 90 | 135.792 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108456 | CIF | O2 Zr | P 1 21/c 1 | 5.059; 5.2097; 5.1763 90; 98.276; 90 | 135.005 | Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations Acta Crystallographica Section B, 2019, 75 |
| 2108457 | CIF HKL | As2 Hg Pb S5 | P n m a | 21.246; 4.2897; 9.5257 90; 90; 90 | 868.2 | Lanza, Arianna E.; Gemmi, Mauro; Bindi, Luca; Mugnaioli, Enrico; Paar, Werner H. Daliranite, PbHgAs~2~S~5~: determination of the incommensurately modulated structure and revision of the chemical formula Acta Crystallographica Section B, 2019, 75 |
| 2108458 | CIF HKL | As2 Hg Pb S5 | P n m a | 21.246; 4.2897; 9.5257 90; 90; 90 | 868.2 | Lanza, Arianna E.; Gemmi, Mauro; Bindi, Luca; Mugnaioli, Enrico; Paar, Werner H. Daliranite, PbHgAs~2~S~5~: determination of the incommensurately modulated structure and revision of the chemical formula Acta Crystallographica Section B, 2019, 75 |
| 2108459 | CIF HKL | C9 H9 N O3 | P 21 21 21 | 8.6793; 9.0674; 10.6085 90; 90; 90 | 834.87 | Hasil, Asma; Mehmood, Arshad; Ahmed, Maqsood Experimental and theoretical charge-density analysis of hippuric acid: insight into its binding with human serum albumin Acta Crystallographica Section B, 2019, 75 |
| 2108460 | CIF HKL | C9 H9 N O3 | P 21 21 21 | 8.6793; 9.0674; 10.6085 90; 90; 90 | 834.87 | Hasil, Asma; Mehmood, Arshad; Ahmed, Maqsood Experimental and theoretical charge-density analysis of hippuric acid: insight into its binding with human serum albumin Acta Crystallographica Section B, 2019, 75 |
| 2108461 | CIF HKL | C9 H9 N O3 | P 21 21 21 | 8.6793; 9.0674; 10.6085 90; 90; 90 | 834.87 | Hasil, Asma; Mehmood, Arshad; Ahmed, Maqsood Experimental and theoretical charge-density analysis of hippuric acid: insight into its binding with human serum albumin Acta Crystallographica Section B, 2019, 75 |
| 2108462 | CIF HKL | C8 H9 N O3 | P 1 21/c 1 | 6.3704; 16.6534; 7.5759 90; 93.9516; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108463 | CIF HKL | C8 H9 N O3 | P 1 21/c 1 | 6.3704; 16.6534; 7.5759 90; 93.9516; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108464 | CIF HKL | C8 H9 N O3 | P 1 21/c 1 | 6.3704; 16.6534; 7.5759 90; 93.9516; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108465 | CIF HKL | C8 H9 N O3 | P -1 | 7.3634; 17.5614; 19.3782 68.688; 83.981; 87.9 | 2321.6 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108466 | CIF | C8 H9 N O3 | P 1 21/a 1 | 14.3673; 16.6534; 6.3704 90; 148.261; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108467 | CIF | C8 H9 N O3 | P 1 21/a 1 | 14.3673; 16.6534; 6.3704 90; 148.261; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108468 | CIF | C8 H9 N O3 | P 1 21/a 1 | 14.3673; 16.6534; 6.3704 90; 148.261; 90 | 801.81 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108469 | CIF | C8 H9 N O3 | P -1 | 42.55; 21.687; 19.9952 130.368; 170.4; 48.973 | 2321 | Ehrmann, Katharina; Baudis, Stefan; Stöger, Berthold From space group to space groupoid: the partial symmetry of low-temperature <i>E</i>-vanillyl oxime Acta Crystallographica Section B, 2019, 75 |
| 2108470 | CIF HKL | C15 H12 N2 O | P 1 21/n 1 | 7.534; 11.15; 13.917 90; 92.94; 90 | 1167.55 | Kolb, Ute; Krysiak, Yaşar; Plana-Ruiz, Sergi Automated electron diffraction tomography ‒ development and applications Acta Crystallographica Section B, 2019, 75, 463-474 |
| 2108471 | CIF HKL | C22 H24 N2 O7 S | P 1 21 1 | 8.71353; 29.496; 17.6717 90; 97.937; 90 | 4498.37 | Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J. Understanding the formation of apremilast cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108472 | CIF HKL | C25 H28 N2 O8.5 S | P 41 21 2 | 12.89179; 12.89179; 29.5087 90; 90; 90 | 4904.29 | Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J. Understanding the formation of apremilast cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108473 | CIF HKL | C25 H27 N3 O7.5 S | P 41 21 2 | 12.81222; 12.81222; 29.7274 90; 90; 90 | 4879.84 | Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J. Understanding the formation of apremilast cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108474 | CIF HKL | C23.5 H25 N3 O7.5 S | P 41 21 2 | 12.85808; 12.85808; 29.5715 90; 90; 90 | 4889.06 | Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J. Understanding the formation of apremilast cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108475 | CIF HKL | C25 H28 N2 O8.5 S | P 41 21 2 | 12.88747; 12.88747; 29.5246 90; 90; 90 | 4903.65 | Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J. Understanding the formation of apremilast cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108476 | CIF | C16 H10 N2 | P n a 21 | 24.316; 3.9011; 25.297 90; 90; 90 | 2399.7 | Sarma, Parishmita; Patir, Khemnath; Sarmah, Kashyap Kumar; Gogoi, Sonit Kumar; Thakuria, Ranjit; Das, Pranab Jyoti Stimuli-responsive aggregation-induced fluorescence in a series of biphenyl-based Knoevenagel products: effects of substituent active methylene groups on π–π interactions Acta Crystallographica Section B, 2019, 75 |
| 2108477 | CIF | C18 H15 N O2 | P -1 | 7.7437; 12.8797; 16.2007 108.298; 102.962; 94.992 | 1473.21 | Sarma, Parishmita; Patir, Khemnath; Sarmah, Kashyap Kumar; Gogoi, Sonit Kumar; Thakuria, Ranjit; Das, Pranab Jyoti Stimuli-responsive aggregation-induced fluorescence in a series of biphenyl-based Knoevenagel products: effects of substituent active methylene groups on π–π interactions Acta Crystallographica Section B, 2019, 75 |
| 2108478 | CIF | C19 H16 O4 | P b c a | 9.221; 9.847; 34.947 90; 90; 90 | 3173.2 | Sarma, Parishmita; Patir, Khemnath; Sarmah, Kashyap Kumar; Gogoi, Sonit Kumar; Thakuria, Ranjit; Das, Pranab Jyoti Stimuli-responsive aggregation-induced fluorescence in a series of biphenyl-based Knoevenagel products: effects of substituent active methylene groups on π–π interactions Acta Crystallographica Section B, 2019, 75 |
| 2108479 | CIF HKL | C26 H20 Cl N3 O | P -1 | 10.5741; 13.5798; 16.6564 107.731; 98.269; 106.98 | 2106.51 | Guo, Chunyang; Zhang, Qi; Zhu, Bingqing; Zhu, Bin; Zhou, Weiqun; Ren, Guobin; Mei, Xuefeng Solvatochromism and mechanochromism observed in a triphenylamine derivative Acta Crystallographica Section B, 2019, 75 |
| 2108480 | CIF HKL | C26 H20 Cl N3 O | P 1 21/c 1 | 15.6975; 23.7324; 12.0002 90; 102.451; 90 | 4365.4 | Guo, Chunyang; Zhang, Qi; Zhu, Bingqing; Zhu, Bin; Zhou, Weiqun; Ren, Guobin; Mei, Xuefeng Solvatochromism and mechanochromism observed in a triphenylamine derivative Acta Crystallographica Section B, 2019, 75 |
| 2108481 | CIF HKL | C26 H20 Eu N3 O7 S | P 1 21/c 1 | 13.9849; 13.1957; 15.1425 90; 109.763; 90 | 2629.8 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108482 | CIF HKL | C67 H58 Er4 N6 O30 S2 | C 1 2/c 1 | 39.336; 8.638; 25.594 90; 124.837; 90 | 7137.9 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108483 | CIF HKL | C67 H58 N6 O30 S2 Yb4 | C 1 2/c 1 | 39.474; 8.6567; 25.67 90; 124.895; 90 | 7195 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108484 | CIF HKL | C58 H36 N6 O15 S2 Tb2 | P 1 21/c 1 | 11.0175; 16.994; 14.608 90; 106.227; 90 | 2626.1 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108485 | CIF HKL | C58 H36 N6 O15 S2 Yb2 | P 1 21/c 1 | 11.0067; 16.9842; 14.5971 90; 106.203; 90 | 2620.4 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108486 | CIF HKL | C29 H18 Eu N3 O7 S | P 1 21/n 1 | 9.1596; 13.4942; 20.727 90; 98.039; 90 | 2536.7 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108487 | CIF HKL | C29 H18 N3 O7 S Tb | P 1 21/n 1 | 9.119; 13.463; 20.674 90; 97.756; 90 | 2514.9 | Hu, Yi-Chen; Bai, Chao; Hu, Huai-Ming; Li, Chuan-Ti; Zhang, Tian-Hua; Liu, Weisheng Lanthanide coordination polymers based on designed bifunctional 2-(2,2':6',2{^{πrimeπrime}}-terpyridin-4'-yl)benzenesulfonate ligand: syntheses, structural diversity and highly tunable emission Acta Crystallographica Section B, 2019, 75 |
| 2108488 | CIF HKL | C12 H14 N2 O5 | P -1 | 7.1402; 7.5689; 11.9955 98.844; 102.693; 100.077 | 610.09 | Zong, Shuyi; Wang, Jingkang; Wu, Hao; Liu, Qi; Hao, Yunhui; Huang, Xin; Wu, Dehui; Zhou, Guanchen; Hao, Hongxun Insight into the role of pre-assembly and desolvation in crystal nucleation: a case of <i>p</i>-nitrobenzoic acid Acta Crystallographica Section B, 2019, 75 |
| 2108489 | CIF HKL Paper | Ca Cu6 O18 P4 Rb2 | C 1 2 1 | 16.8913; 5.6406; 8.3591 90; 93.919; 90 | 794.57 | Aksenov, Sergey M.; Borovikova, Elena Yu.; Mironov, Vladimir S.; Yamnova, Natalia A.; Volkov, Anatoly S.; Ksenofontov, Dmitry A.; Gurbanova, Olga A.; Dimitrova, Olga V.; Deyneko, Dina V.; Zvereva, Elena A.; Maximova, Olga V.; Krivovichev, Sergey V.; Burns, Peter C.; Vasiliev, Alexander N. Rb~2~CaCu~6~(PO~4~)~4~O~2~, a novel oxophosphate with a shchurovskyite-type topology: synthesis, structure, magnetic properties and crystal chemistry of rubidium copper phosphates Acta Crystallographica Section B, 2019, 75 |
| 2108490 | CIF HKL | C16 H12 N2 O2 | P -1 | 4.8281; 8.5805; 15.436 96.79; 95.002; 91.404 | 632.18 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108491 | CIF HKL | C17 H14 N2 O2 | P -1 | 4.8956; 9.6425; 14.958 103.662; 94.58; 98.382 | 673.98 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108492 | CIF HKL | C16 H11 F N2 O2 | P -1 | 4.6371; 8.957; 15.788 99.88; 96.61; 93.21 | 639.8 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108493 | CIF HKL | C16 H11 F N2 O2 | P 1 21/c 1 | 4.6995; 30.579; 8.853 90; 92.7; 90 | 1270.8 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108494 | CIF HKL | C16 H11 Cl N2 O2 | P 1 21/c 1 | 4.3746; 30.823; 9.855 90; 93.225; 90 | 1326.7 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108495 | CIF HKL | C16 H11 Br N2 O2 | P 1 21/c 1 | 4.1661; 31.0277; 10.4434 90; 92.933; 90 | 1348.19 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108496 | CIF HKL | C16 H11 Br N2 O2 | P 1 21/c 1 | 6.9397; 10.2611; 20.7644 90; 96.919; 90 | 1467.84 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108497 | CIF HKL | C16 H11 I N2 O2 | P 1 21/c 1 | 6.9395; 10.2583; 20.7605 90; 96.931; 90 | 1467.09 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108498 | CIF HKL | C17 H14 N2 O3 | P 1 21/c 1 | 6.9921; 10.1424; 20.862 90; 99.57; 90 | 1458.9 | Shishkina, Svitlana V.; Konovalova, Irina S.; Kovalenko, Sergiy M.; Trostianko, Pavlo V.; Geleverya, Anna O.; Nikolayeva, Lyudmila L.; Bunyatyan, Natalya D. Influence of <i>ortho</i>-substituent on the molecular and crystal structures of 2-(<i>N</i>-arylimino)coumarin-3-carboxamide: isotypic and polymorphic structures Acta Crystallographica Section B, 2019, 75 |
| 2108499 | CIF HKL Paper | C16 H22 Cl3 N3 O2 | C 1 2/c 1 | 23.0502; 6.7836; 25.4596 90; 114.262; 90 | 3629.33 | Gaztañaga, Pablo; Baggio, Ricardo; Vega, Daniel Roberto Polymorphic forms of bendamustine hydrochloride: crystal structure, thermal properties and stability at ambient conditions Acta Crystallographica Section B, 2019, 75 |
| 2108500 | CIF HKL Paper | C16 H24 Cl3 N3 O3 | P 1 21/c 1 | 4.649; 47.213; 8.9051 90; 96.222; 90 | 1943.1 | Gaztañaga, Pablo; Baggio, Ricardo; Vega, Daniel Roberto Polymorphic forms of bendamustine hydrochloride: crystal structure, thermal properties and stability at ambient conditions Acta Crystallographica Section B, 2019, 75 |
| 2108501 | CIF HKL Paper | C16 H22 Cl3 N3 O2 | P 1 21/c 1 | 4.722; 45.671; 8.798 90; 97.66; 90 | 1880 | Gaztañaga, Pablo; Baggio, Ricardo; Vega, Daniel Roberto Polymorphic forms of bendamustine hydrochloride: crystal structure, thermal properties and stability at ambient conditions Acta Crystallographica Section B, 2019, 75 |
| 2108502 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | P 31 2 1 | 9.5177; 9.5177; 7.538 90; 90; 120 | 591.36 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108503 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | P 31 2 1 | 9.5245; 9.5245; 7.5481 90; 90; 120 | 592.997 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108504 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | P 31 2 1 | 9.5291; 9.5291; 7.5601 90; 90; 120 | 594.514 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108505 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | P 31 2 1 | 9.5301; 9.5301; 7.5615 90; 90; 120 | 594.749 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108506 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | R 3 2 :H | 9.5351; 9.5351; 7.5633 90; 90; 120 | 595.515 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108507 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | R 3 2 :H | 9.5349; 9.5349; 7.5641 90; 90; 120 | 595.553 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108508 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | R 3 2 :H | 9.5359; 9.5359; 7.5659 90; 90; 120 | 595.82 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108509 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | R 3 2 :H | 9.5364; 9.5364; 7.5677 90; 90; 120 | 596.02 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108510 | CIF HKL | B4 Bi0.037 Fe3 Ho0.963 O12 | R 3 2 :H | 9.5394; 9.5394; 7.5693 90; 90; 120 | 596.525 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Khmelenin, Dmitry N.; Frolov, Kirill V.; Lyubutina, Marianna V.; Gudim, Irina A.; Lyubutin, Igor S. Crystal structure and structural phase transition in bismuth-containing HoFe~3~(BO~3~)~4~ in the temperature range 11‒500 K Acta Crystallographica Section B, 2019, 75 |
| 2108511 | CIF HKL | C6 H9 N3 O3 | P 1 21/c 1 | 6.8785; 8.6396; 12.8573 90; 94.351; 90 | 761.875 | Kalaiarasi, Chinnasamy; Christy, George; Gonnade, Rajesh G.; Hathwar, Venkatesha R.; Kumaradhas, Poomani Experimental and theoretical charge density, intermolecular interactions and electrostatic properties of metronidazole Acta Crystallographica Section B, 2019, 75 |
| 2108512 | CIF HKL | C21 H23 N O4 | P 21 21 21 | 7.2015; 12.2326; 21.3487 90; 90; 90 | 1880.67 | Lee, Min-Jeong; Aitipamula, Srinivasulu; Choi, Guang J.; Chow, Pui Shan Agomelatine–hydroquinone (1:1) cocrystal: novel polymorphs and their thermodynamic relationship Acta Crystallographica Section B, 2019, 75 |
| 2108513 | CIF HKL | C21 H23 N O4 | P 1 21 1 | 7.333; 29.3095; 8.8046 90; 94.748; 90 | 1885.85 | Lee, Min-Jeong; Aitipamula, Srinivasulu; Choi, Guang J.; Chow, Pui Shan Agomelatine–hydroquinone (1:1) cocrystal: novel polymorphs and their thermodynamic relationship Acta Crystallographica Section B, 2019, 75 |
| 2108514 | CIF HKL | C18 H12 N6 | I 1 2/a 1 | 21.3047; 3.7345; 35.1825 90; 93.364; 90 | 2794.4 | Yuan, Liangqian; Xing, Mengyao; Pan, Fangfang Polymorphs of 2,4,6-tris(4-pyridyl)-1,3,5-triazine and their mechanical properties Acta Crystallographica Section B, 2019, 75 |
| 2108515 | CIF HKL Paper | C7 H9 Br N2 O2 | P 1 21/m 1 | 8.5689; 6.4113; 8.8248 90; 110.2; 90 | 455 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108516 | CIF HKL | C7 H9 I N2 O2 | P -1 | 6.5954; 8.7764; 8.8564 72.14; 84.002; 81.83 | 481.98 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108517 | CIF HKL | C7 H9 N3 O5 | P 1 21/m 1 | 8.1234; 6.6252; 8.5799 90; 98.712; 90 | 456.44 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108518 | CIF HKL | C7 H9 Cl N2 O2 | P -1 | 7.9756; 7.9803; 28.2986 84.468; 84.229; 89.897 | 1783.61 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108519 | CIF HKL | C7 H10 N2 O6 S | P n a 21 | 12.8927; 4.97471; 31.5518 90; 90; 90 | 2023.65 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108520 | CIF HKL | C7 H10 I3 N2 O2.5 | P 1 21/c 1 | 11.2876; 13.9536; 17.5279 90; 96.808; 90 | 2741.23 | Medviediev, Volodymyr; Daszkiewicz, Marek Structural, theoretic and spectroscopic analysis of 2-methyl-5-nitroaniline salts with various inorganic acids Acta Crystallographica Section B, 2019, 75 |
| 2108521 | CIF HKL | Cu6 H16 O21 S2 Zn | P 3 | 8.1905; 8.1905; 7.099 90; 90; 120 | 412.43 | Elliott, Peter Hodgesmithite, (Cu,Zn)~6~Zn(SO~4~)~2~(OH)~10~·3H~2~O, a new copper zinc sulfate mineral with a unique, decorated, interrupted-sheet structure Acta Crystallographica Section B, 2019, 75 |
| 2108522 | CIF HKL Paper | C24 H40 Cl N5 O7 S | P 1 21/c 1 | 16.638; 12.0355; 15.4979 90; 107.668; 90 | 2957.02 | Zhang, Guoshun; Wang, Na; Shang, Xiaoqing; Zhang, Lifeng; Wang, Ruili; Zhang, Shuqiu Solvates of acotiamide hydrochloride: characterization and phase transformation Acta Crystallographica Section B, 2019, 75 |
| 2108523 | CIF HKL | C23 H37 Cl N4 O6 S2 | P -1 | 8.0881; 11.276; 16.2993 98.21; 95.377; 101.106 | 1432.44 | Zhang, Guoshun; Wang, Na; Shang, Xiaoqing; Zhang, Lifeng; Wang, Ruili; Zhang, Shuqiu Solvates of acotiamide hydrochloride: characterization and phase transformation Acta Crystallographica Section B, 2019, 75 |
| 2108524 | CIF HKL | C23 H37 Cl N4 O6 S2 | P -1 | 10.4385; 10.7052; 14.2725 90.444; 95.087; 113.92 | 1450.5 | Zhang, Guoshun; Wang, Na; Shang, Xiaoqing; Zhang, Lifeng; Wang, Ruili; Zhang, Shuqiu Solvates of acotiamide hydrochloride: characterization and phase transformation Acta Crystallographica Section B, 2019, 75 |
| 2108525 | CIF HKL | C23 H39 Cl N4 O7 S2 | P 1 21/c 1 | 16.508; 11.873; 15.442 90; 103.917; 90 | 2937.8 | Zhang, Guoshun; Wang, Na; Shang, Xiaoqing; Zhang, Lifeng; Wang, Ruili; Zhang, Shuqiu Solvates of acotiamide hydrochloride: characterization and phase transformation Acta Crystallographica Section B, 2019, 75 |
| 2108526 | CIF HKL | C50 H82 Cl2 N8 O14 S4 | P -1 | 11.55; 15.6355; 18.5836 93.782; 99.353; 105.965 | 3161.9 | Zhang, Guoshun; Wang, Na; Shang, Xiaoqing; Zhang, Lifeng; Wang, Ruili; Zhang, Shuqiu Solvates of acotiamide hydrochloride: characterization and phase transformation Acta Crystallographica Section B, 2019, 75 |
| 2108527 | CIF HKL | C40 H36 N2 S5 Si2 | P -1 | 10.0612; 14.6933; 14.3275 72.2555; 71.6334; 87.9619 | 1910.25 | Postnikov, Valery A.; Sorokina, Nataliya I.; Kulishov, Artem A.; Lyasnikova, Maria S.; Grebenev, Vadim V.; Voloshin, Alexey E.; Borshchev, Oleg V.; Skorotetcky, Maxim S.; Surin, Nikolay M.; Svidchenko, Evgeniya A.; Ponomarenko, Sergei A. Highly luminescent crystals of a novel linear π-conjugated thiophene‒phenylene co-oligomer with a benzothiadiazole fragment Acta Crystallographica Section B, 2019, 75 |
| 2108528 | CIF HKL | C40 H36 N2 S5 Si2 | P -1 | 9.805; 14.4191; 14.4368 72.3867; 72.9136; 87.8897 | 1856.5 | Postnikov, Valery A.; Sorokina, Nataliya I.; Kulishov, Artem A.; Lyasnikova, Maria S.; Grebenev, Vadim V.; Voloshin, Alexey E.; Borshchev, Oleg V.; Skorotetcky, Maxim S.; Surin, Nikolay M.; Svidchenko, Evgeniya A.; Ponomarenko, Sergei A. Highly luminescent crystals of a novel linear π-conjugated thiophene–phenylene co-oligomer with a benzothiadiazole fragment Acta Crystallographica Section B, 2019, 75 |
| 2108529 | CIF HKL Paper | C39 H31.4 Cu2 N5 O12.7 S2 | P 1 21/n 1 | 11.1292; 18.8549; 19.3898 90; 99.51; 90 | 4012.8 | Zhang, Shunlin; Gao, Sheng; Wang, Xin; He, Xin; Zhao, Jing; Zhu, Dunru Two topologically different 3D Cu^II^ metal‒organic frameworks assembled from the same ligands: control of reaction conditions Acta Crystallographica Section B, 2019, 75 |
| 2108530 | CIF HKL | C38 H37 Cu2 N5 O14 S2 | P 1 21/c 1 | 11.123; 23.956; 16.026 90; 107.374; 90 | 4075 | Zhang, Shunlin; Gao, Sheng; Wang, Xin; He, Xin; Zhao, Jing; Zhu, Dunru Two topologically different 3D Cu^II^ metal‒organic frameworks assembled from the same ligands: control of reaction conditions Acta Crystallographica Section B, 2019, 75 |
| 2108539 | CIF HKL | Al9.12 Ca5.98 Fe30.7 Mg5.34 O72 Si0.86 | P -1 | 10.3279; 10.434; 14.3794 93.4888; 107.321; 109.663 | 1370.49 | Kahlenberg, Volker; Krüger, Hannes; Goettgens, Valerie Sue Structural elucidation of triclinic and monoclinic SFCA-III ‒ killing two birds with one stone Acta Crystallographica Section B, 2019, 75 |
| 2108540 | CIF | Al18.241 Ca11.96 Fe61.4 Mg10.68 O144 Si1.72 | P 1 21/n 1 | 10.3277; 27.0134; 10.4344 90; 109.668; 90 | 2741.22 | Kahlenberg, Volker; Krüger, Hannes; Goettgens, Valerie Sue Structural elucidation of triclinic and monoclinic SFCA-III ‒ killing two birds with one stone Acta Crystallographica Section B, 2019, 75 |
| 2108541 | CIF HKL | F7 H12 N5 O Ru Si | P 1 n 1 | 6.7036; 7.426; 10.1296 90; 107.469; 90 | 481 | Mikhailov, Artem; Vuković, Vedran; Kijatkin, Christian; Wenger, Emmanuel; Imlau, Mirco; Woike, Theo; Kostin, Gennadiy; Schaniel, Dominik Combining photoinduced linkage isomerism and nonlinear optical properties in ruthenium nitrosyl complexes Acta Crystallographica Section B, 2019, 75 |
| 2108542 | CIF HKL | F6 H12 N3 O Ta | F m -3 m | 9.331; 9.331; 9.331 90; 90; 90 | 812.427 | Udovenko, Anatoly A.; Laptash, Natalia M. Ammonium tantalum oxide fluorides: new features of dynamic disorder Acta Crystallographica Section B, 2019, 75 |
| 2108543 | CIF HKL | F7.66 H12 N3 O0.17 Ta | R -3 m :H | 8.5414; 8.5414; 41.4381 90; 90; 120 | 2618.11 | Udovenko, Anatoly A.; Laptash, Natalia M. Ammonium tantalum oxide fluorides: new features of dynamic disorder Acta Crystallographica Section B, 2019, 75 |
| 2108544 | CIF HKL | F7.5 H11 N2.75 O0.125 Ta | P n m a | 11.5018; 8.5736; 33.4597 90; 90; 90 | 3299.52 | Udovenko, Anatoly A.; Laptash, Natalia M. Ammonium tantalum oxide fluorides: new features of dynamic disorder Acta Crystallographica Section B, 2019, 75 |
| 2108545 | CIF HKL | F7.5 H11 N2.75 O0.125 Ta | P 1 21/c 1 | 35.0618; 8.5377; 22.7987 90; 108.991; 90 | 6453.3 | Udovenko, Anatoly A.; Laptash, Natalia M. Ammonium tantalum oxide fluorides: new features of dynamic disorder Acta Crystallographica Section B, 2019, 75 |
| 2108546 | CIF HKL | F7 H8 N2 Ta | P 4/n m m :2 | 5.8613; 5.8613; 10.5817 90; 90; 90 | 363.53 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2108547 | CIF HKL | F7 Rb2 Ta | C m m a | 8.2419; 8.2749; 10.5694 90; 90; 90 | 720.84 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2108548 | CIF HKL | F7 Rb2 Ta | P 4/n m m :2 | 5.9118; 5.9118; 10.6173 90; 90; 90 | 371.07 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2108549 | CIF HKL | F6 O Rb3 Ta | F m -3 m | 9.1842; 9.1842; 9.1842 90; 90; 90 | 774.68 | Udovenko, Anatoly A.; Slobodyuk, Arseny B.; Emelina, Tatiana B.; Laptash, Natalia M. Fluxional seven-coordinated fluorido- and oxofluoridotantalates Acta Crystallographica Section B, 2019, 75 |
| 2108550 | CIF HKL | C5 H15 Fe N2 O12 S2 | C 1 2/c 1 | 12.1601; 17.2511; 6.7758 90; 100.715; 90 | 1396.61 | Bednarchuk, Tamara J.; Hornfeck, Wolfgang; Kinzhybalo, Vasyl; Zhou, Zhengyang; Dušek, Michal; Pietraszko, Adam The structures and phase transitions in 4-aminopyridinium tetraaquabis(sulfato)iron(III), (C~5~H~7~N~2~)[Fe^III^(H~2~O)~4~(SO~4~)~2~] Acta Crystallographica Section B, 2019, 75 |
| 2108551 | CIF HKL | C5 H15 Fe N2 O12 S2 | C 1 2/c 1 | 12.175; 17.217; 6.769 90; 100.87; 90 | 1393.4 | Bednarchuk, Tamara J.; Hornfeck, Wolfgang; Kinzhybalo, Vasyl; Zhou, Zhengyang; Dušek, Michal; Pietraszko, Adam The structures and phase transitions in 4-aminopyridinium tetraaquabis(sulfato)iron(III), (C~5~H~7~N~2~)[Fe^III^(H~2~O)~4~(SO~4~)~2~] Acta Crystallographica Section B, 2019, 75 |
| 2108552 | CIF HKL | C5 H15 Fe N2 O12 S2 | P -1 | 10.516; 11.873; 13.099 65.34; 77.51; 68.73 | 1381 | Bednarchuk, Tamara J.; Hornfeck, Wolfgang; Kinzhybalo, Vasyl; Zhou, Zhengyang; Dušek, Michal; Pietraszko, Adam The structures and phase transitions in 4-aminopyridinium tetraaquabis(sulfato)iron(III), (C~5~H~7~N~2~)[Fe^III^(H~2~O)~4~(SO~4~)~2~] Acta Crystallographica Section B, 2019, 75 |
| 2108553 | CIF HKL Paper | B Cs H2 O8 P2 | I 1 2/a 1 | 13.4002; 7.4869; 14.5329 90; 90.059; 90 | 1458.03 | Shvanskaya, Larisa; Yakubovich, Olga; Krikunova, Polina; Ovchenkov, Evgeny; Vasiliev, Alexander Chain caesium borophosphates with B:P ratio 1:2: synthesis, structure relationships and low-temperature thermodynamic properties Acta Crystallographica Section B, 2019, 75 |
| 2108554 | CIF HKL | B Cs0.51 H4.9 Mn1.17 O10.45 P2 | P 61 2 2 | 9.6292; 9.6292; 15.8051 90; 90; 120 | 1269.14 | Shvanskaya, Larisa; Yakubovich, Olga; Krikunova, Polina; Ovchenkov, Evgeny; Vasiliev, Alexander Chain caesium borophosphates with B:P ratio 1:2: synthesis, structure relationships and low-temperature thermodynamic properties Acta Crystallographica Section B, 2019, 75 |
| 2108555 | CIF HKL | B Cs H Mn O9 P2 | P 1 21/c 1 | 9.1494; 8.6991; 9.6413 90; 100.141; 90 | 755.38 | Shvanskaya, Larisa; Yakubovich, Olga; Krikunova, Polina; Ovchenkov, Evgeny; Vasiliev, Alexander Chain caesium borophosphates with B:P ratio 1:2: synthesis, structure relationships and low-temperature thermodynamic properties Acta Crystallographica Section B, 2019, 75 |
| 2108556 | CIF HKL | C64 H60 N6 O6 | P -1 | 8.0448; 9.9408; 17.371 104.203; 90.628; 91.751 | 1345.9 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108557 | CIF HKL | C38 H32 N4 O3 | P 1 21/c 1 | 8.9669; 36.365; 9.6042 90; 94.898; 90 | 3120.3 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108558 | CIF HKL | C38 H32 N4 O3 | P -1 | 9.718; 12.072; 15.426 72.697; 72.681; 67.465 | 1560.9 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108559 | CIF HKL | C26 H22 N2 O3 | P 1 21/c 1 | 24.4184; 6.5303; 12.7495 90; 90.172; 90 | 2033 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108560 | CIF HKL | C67 H60 N6 O7 | P -1 | 12.215; 15.89; 17.769 114.901; 92.443; 111.284 | 2835.9 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108561 | CIF HKL | C33 H31 N3 O4 | P -1 | 11.765; 11.892; 12.314 95.213; 111.706; 114.134 | 1400 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108562 | CIF HKL | C34 H28 N8 O3 | C 1 2/c 1 | 17.606; 7.969; 42.568 90; 97.006; 90 | 5928 | Peng, Bo; He, Hongyan; Li, Meiqi; Wang, Jian-Rong; Mei, Xuefeng Comparison of the crystal structures and physicochemical properties of novel resveratrol cocrystals Acta Crystallographica Section B, 2019, 75 |
| 2108563 | CIF HKL Paper | C18 H14 Cl2 N2 O | P 1 21/c 1 | 11.351; 16.259; 9.589 90; 107.41; 90 | 1688.6 | Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Macías, Mario A.; Portilla, Jaime Intermolecular interaction energies and molecular conformations in <i>N</i>-substituted 4-aryl-2-methylimidazoles with promising <i>in vitro</i> antifungal activity Acta Crystallographica Section B, 2019, 75 |
| 2108564 | CIF HKL | C18 H14 F2 N2 O | P b c a | 11.984; 9.537; 26.808 90; 90; 90 | 3063.9 | Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Macías, Mario A.; Portilla, Jaime Intermolecular interaction energies and molecular conformations in <i>N</i>-substituted 4-aryl-2-methylimidazoles with promising <i>in vitro</i> antifungal activity Acta Crystallographica Section B, 2019, 75 |
| 2108565 | CIF HKL | C18 H12 Cl4 N2 O | P -1 | 4.4932; 10.9707; 18.786 76.483; 83.305; 78.976 | 881.25 | Elejalde, Nerith-Rocio; Butassi, Estefanía; Zacchino, Susana; Macías, Mario A.; Portilla, Jaime Intermolecular interaction energies and molecular conformations in <i>N</i>-substituted 4-aryl-2-methylimidazoles with promising <i>in vitro</i> antifungal activity Acta Crystallographica Section B, 2019, 75 |
| 2108566 | CIF HKL | C7 H7.75 N Na O4.875 S | P 1 21/n 1 | 18.6212; 28.4622; 29.1642 90; 93.4511; 90 | 15429 | Rekis, Toms; Schönleber, Andreas; van Smaalen, Sander On the puzzling case of sodium saccharinate 1.875-hydrate: structure description in (3+1)-dimensional superspace Acta Crystallographica Section B, 2020, 76 |
| 2108567 | CIF HKL | C7 H4 N Na O4.875 S | C 1 2/n 1 | 18.6212; 7.11555; 29.1642 90; 93.4511; 90 | 3857.25 | Rekis, Toms; Schönleber, Andreas; van Smaalen, Sander On the puzzling case of sodium saccharinate 1.875-hydrate: structure description in (3+1)-dimensional superspace Acta Crystallographica Section B, 2020, 76 |
| 2108568 | CIF HKL | C11 H9 N O S | P 1 21/c 1 | 15.0288; 5.3086; 24.444 90; 99.133; 90 | 1925.47 | Sweeting, Stephen G.; Hall, Charlie L.; Potticary, Jason; Pridmore, Natalie E.; Warren, Stephen D.; Cremeens, Matthew E.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Hall, Simon R. The solubility and stability of heterocyclic chalcones compared with <i>trans</i>-chalcone Acta Crystallographica Section B, 2020, 76 |
| 2108569 | CIF HKL Paper | Cd41 Ir8 | R -3 :H | 14.896; 14.896; 16.0338 90; 90; 120 | 3081.1 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108570 | CIF HKL Paper | Cd86.45 Cu7.147 Ir7.318 | F -4 3 m | 19.9445; 19.9445; 19.9445 90; 90; 90 | 7933.6 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108571 | CIF HKL Paper | Cd86.366 Cu7.584 Ir6.698 | F -4 3 m | 19.922; 19.922; 19.922 90; 90; 90 | 7907 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108572 | CIF HKL Paper | Cd81.199 Cu15.659 Ir5.873 | F -4 3 m | 19.785; 19.785; 19.785 90; 90; 90 | 7744.8 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108573 | CIF HKL Paper | Cd81.64 Cu15.796 Ir5.306 | F -4 3 m | 19.8332; 19.8332; 19.8332 90; 90; 90 | 7801.5 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108574 | CIF HKL Paper | Cd80.144 Cu17.218 Ir5.638 | F -4 3 m | 19.7041; 19.7041; 19.7041 90; 90; 90 | 7650.1 | Ghanta, Sivaprasad; Roy, Nilanjan; Jana, Partha Pratim Crystal structures of two very similar 2×2×2 superstructures of γ-brass-related phases in ternary Ir‒Cd‒Cu system Acta Crystallographica Section B, 2020, 76 |
| 2108575 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 8.1928; 5.4539; 20.07 90; 91.47; 90 | 896 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108576 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 8.24; 5.4015; 19.519 90; 91.55; 90 | 868 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108577 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 6.305; 5.1839; 24.94 90; 96.25; 90 | 810 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108578 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 6.3679; 5.1671; 24.58 90; 96.25; 90 | 804 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108579 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 6.341; 5.1594; 24.52 90; 96.05; 90 | 798 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108580 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 8.171; 5.3995; 19.515 90; 92; 90 | 860.5 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108581 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 6.3608; 5.183; 24.75 90; 96.66; 90 | 810.5 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108582 | CIF HKL | C9 H11 N O2 | P 1 21/c 1 | 6.3399; 5.1789; 24.8 90; 96.58; 90 | 809 | Patyk-Kaźmierczak, Ewa; Kaźmierczak, Michał A new high-pressure benzocaine polymorph — towards understanding the molecular aggregation in crystals of an important active pharmaceutical ingredient (API) Acta Crystallographica Section B, 2020, 76 |
| 2108583 | CIF HKL Paper | C30 H44 N30 O32 V10 | P -1 | 11.3756; 11.5611; 14.0894 73.533; 67.176; 60.845 | 1481.18 | Sedghiniya, Sima; Soleimannejad, Janet; Jahani, Zohreh; Davoodi, Jamshid; Janczak, Jan Crystal engineering of an adenine–decavanadate molecular device towards label-free chemical sensing and biological screening Acta Crystallographica Section B, 2020, 76 |
| 2108584 | CIF HKL | C8 H7 N O3 | P 1 21/c 1 | 8.7958; 7.5909; 10.8134 90; 104.722; 90 | 698.29 | Malinska, Maura; Kieliszek, Aleksandra; Kozioł, Anna E.; Mirosław, Barbara; Woźniak, Krzysztof Interplay between packing, dimer interaction energy and morphology in a series of tricyclic imide crystals Acta Crystallographica Section B, 2020, 76 |
| 2108585 | CIF HKL | C10 H11 N O3 | P 1 21/c 1 | 8.74; 10.989; 9.736 90; 90.75; 90 | 935 | Malinska, Maura; Kieliszek, Aleksandra; Kozioł, Anna E.; Mirosław, Barbara; Woźniak, Krzysztof Interplay between packing, dimer interaction energy and morphology in a series of tricyclic imide crystals Acta Crystallographica Section B, 2020, 76 |
| 2108586 | CIF HKL | C10 H11 N O3 | P -1 | 7.8898; 8.5729; 14.2922 88.333; 89.646; 73.099 | 924.56 | Malinska, Maura; Kieliszek, Aleksandra; Kozioł, Anna E.; Mirosław, Barbara; Woźniak, Krzysztof Interplay between packing, dimer interaction energy and morphology in a series of tricyclic imide crystals Acta Crystallographica Section B, 2020, 76 |
| 2108587 | CIF HKL | C9 H9 N O4 | P 1 21/n 1 | 11.6065; 7.3059; 20.0511 90; 99.977; 90 | 1674.54 | Malinska, Maura; Kieliszek, Aleksandra; Kozioł, Anna E.; Mirosław, Barbara; Woźniak, Krzysztof Interplay between packing, dimer interaction energy and morphology in a series of tricyclic imide crystals Acta Crystallographica Section B, 2020, 76 |
| 2108588 | CIF HKL | C24 H14 Cu N6 O12 | P 1 21/c 1 | 11.2998; 25.77; 9.3086 90; 111.894; 90 | 2515.1 | Torres, Juan F.; Bello-Vieda, Nestor J.; Macías, Mario A.; Rabelo, Renato; Lloret, Francisco; Muñoz-Castro, Alvaro; Hurtado, John J. Intermolecular interaction energies and magnetic properties of spin-isolated multinuclear Cu^II^ complexes Acta Crystallographica Section B, 2020, 76 |
| 2108589 | CIF HKL | C52 H28 Cu2 N12 O24 | P 1 21/c 1 | 11.285; 26.65; 9.4293 90; 111.31; 90 | 2641.9 | Torres, Juan F.; Bello-Vieda, Nestor J.; Macías, Mario A.; Rabelo, Renato; Lloret, Francisco; Muñoz-Castro, Alvaro; Hurtado, John J. Intermolecular interaction energies and magnetic properties of spin-isolated multinuclear Cu^II^ complexes Acta Crystallographica Section B, 2020, 76 |
| 2108590 | CIF HKL Paper | C25 H44 Cl N O10 | P 21 21 21 | 16.3296; 16.3759; 31.1186 90; 90; 90 | 8321.5 | Li, Han-qing; Xu, Jia-yin; Gao, Yuan-yuan; Jin, Liang; Chen, Jian-ming; Chen, Feng-zheng Supramolecular structure, <i>in vivo</i> biological activities and molecular-docking-based potential cardiotoxic exploration of aconine hydrochloride monohydrate as a novel salt form Acta Crystallographica Section B, 2020, 76 |
| 2108591 | CIF HKL | C28 H50 Cu N6 O7 | P -1 | 10.946; 12.502; 13.029 70.34; 79.99; 73.06 | 1600.5 | Shin, Jong Won; Jeong, Ah Rim; Kim, Younghak; Kim, Dae-Woong; Lee, Sang-Geul; Lee, Hyosun; Moon, Dohyun Solvent-triggered single-crystal-to-single-crystal transformation from a monomeric to polymeric copper(II) complex based on an aza macrocyclic ligand Acta Crystallographica Section B, 2020, 76 |
| 2108592 | CIF HKL | C30 H52 Cu N6 O6 | P b c n | 11.386; 14.063; 21.427 90; 90; 90 | 3430.9 | Shin, Jong Won; Jeong, Ah Rim; Kim, Younghak; Kim, Dae-Woong; Lee, Sang-Geul; Lee, Hyosun; Moon, Dohyun Solvent-triggered single-crystal-to-single-crystal transformation from a monomeric to polymeric copper(II) complex based on an aza macrocyclic ligand Acta Crystallographica Section B, 2020, 76 |
| 2108593 | CIF HKL | C60 H80 O46 | P -1 | 10.2989; 14.3586; 14.5679 115.521; 103.49; 100.116 | 1794.4 | Balakrishnan, C.; Manonmani, M.; Rafi Ahamed, S.; Vinitha, G.; Meenakshisundaram, S. P.; Sockalingam, R. M. Supramolecular cocrystals of O—H···O hydrogen-bonded 18-crown-6 with isophthalic acid derivatives: Hirshfeld surface analysis and third-order nonlinear optical properties Acta Crystallographica Section B, 2020, 76 |
| 2108594 | CIF HKL | C30 H40 O20 | P -1 | 7.5073; 8.0208; 14.723 77.133; 79.494; 84.408 | 848.29 | Balakrishnan, C.; Manonmani, M.; Rafi Ahamed, S.; Vinitha, G.; Meenakshisundaram, S. P.; Sockalingam, R. M. Supramolecular cocrystals of O—H···O hydrogen-bonded 18-crown-6 with isophthalic acid derivatives: Hirshfeld surface analysis and third-order nonlinear optical properties Acta Crystallographica Section B, 2020, 76 |
| 2108595 | CIF HKL Paper | C34 H44 Mg N6 O10 S2 | P 1 21/c 1 | 17.475; 8.051; 14.19 90; 109.91; 90 | 1877.1 | Abouhakim, Hanane; Nilsson Lill, Sten O.; Quayle, Michael J.; Norberg, Stefan T.; Hassanpour, Ali; Pask, Christopher M. The crystal structure, morphology and mechanical properties of diaquabis(omeprazolate)magnesium dihydrate Acta Crystallographica Section B, 2020, 76 |
| 2108596 | CIF | C10 H8 N4 O5 | P 1 21/c 1 | 11.67; 11.4666; 8.494 90; 106.848; 90 | 1087.8 | Dudek, Marta K.; Paluch, Piotr; Pindelska, Edyta Crystal structures of two furazidin polymorphs revealed by a joint effort of crystal structure prediction and NMR crystallography Acta Crystallographica Section B, 2020, 76 |
| 2108597 | CIF HKL | C20 H16 N8 O10 | P -1 | 22.183; 12.546; 5.3092 51.074; 92.16; 97.31 | 1138.5 | Dudek, Marta K.; Paluch, Piotr; Pindelska, Edyta Crystal structures of two furazidin polymorphs revealed by a joint effort of crystal structure prediction and NMR crystallography Acta Crystallographica Section B, 2020, 76 |
| 2108598 | CIF HKL | C21 H14 N2 O2 | P -1 | 3.82563; 6.50848; 15.2148 89.522; 91.9447; 101.226 | 371.37 | Schlesinger, Carina; Hammer, Sonja M.; Gorelik, Tatiana E.; Schmidt, Martin U. Orientational disorder of monomethyl-quinacridone investigated by Rietveld refinement, structure refinement to the pair distribution function and lattice-energy minimizations Acta Crystallographica Section B, 2020, 76 |
| 2108599 | CIF | C24 H22 F4 Si2 | P 1 21/c 1 | 6.7352; 14.8514; 23.3648 90; 94.735; 90 | 2329.1 | Moliterni, Anna; Altamura, Davide; Lassandro, Rocco; Olieric, Vincent; Ferri, Gianmarco; Cardarelli, Francesco; Camposeo, Andrea; Pisignano, Dario; Anthony, John E.; Giannini, Cinzia Synthesis, crystal structure, polymorphism and microscopic luminescence properties of anthracene derivative compounds Acta Crystallographica Section B, 2020, 76 |
| 2108600 | CIF HKL Paper | C24 H22 F4 Si2 | P 1 21/c 1 | 6.905; 14.948; 23.66 90; 94.82; 90 | 2433.5 | Moliterni, Anna; Altamura, Davide; Lassandro, Rocco; Olieric, Vincent; Ferri, Gianmarco; Cardarelli, Francesco; Camposeo, Andrea; Pisignano, Dario; Anthony, John E.; Giannini, Cinzia Synthesis, crystal structure, polymorphism and microscopic luminescence properties of anthracene derivative compounds Acta Crystallographica Section B, 2020, 76 |
| 2108601 | CIF HKL | C36 H50 Si2 | P -1 | 8.602; 10.085; 11.209 115.07; 102.61; 98.82 | 825.6 | Moliterni, Anna; Altamura, Davide; Lassandro, Rocco; Olieric, Vincent; Ferri, Gianmarco; Cardarelli, Francesco; Camposeo, Andrea; Pisignano, Dario; Anthony, John E.; Giannini, Cinzia Synthesis, crystal structure, polymorphism and microscopic luminescence properties of anthracene derivative compounds Acta Crystallographica Section B, 2020, 76 |
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