Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section B'

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2108282 CIF
HKL
C18 H24 Au Fe PP b c a13.8732; 11.6316; 22.124
90; 90; 90
3570.1Makal, Anna
Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I)
Acta Crystallographica Section B, 2018, 74
2108283 CIF
HKL
C18 H24 Au Fe PP b 21 a13.872; 11.644; 21.96
90; 90; 90
3547Makal, Anna
Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I)
Acta Crystallographica Section B, 2018, 74
2108284 CIF
HKL
C18 H24 Au Fe PP b c a14.0011; 11.6244; 21.893
90; 90; 90
3563.2Makal, Anna
Triethylphosphine as a molecular gear — phase transitions in ferrocenyl‒acetylide‒gold(I)
Acta Crystallographica Section B, 2018, 74
2108285 CIF
HKL
Paper
C14 H8 F3 OP 1 21/c 123.238; 7.5293; 6.2437
90; 92.83; 90
1091.1Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S.
Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer
Acta Crystallographica Section B, 2018, 74
2108286 CIF
HKL
Paper
C14 H8 F3 OP 1 21/c 111.505; 6.235; 16.0118
90; 109.293; 90
1084.08Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S.
Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer
Acta Crystallographica Section B, 2018, 74
2108287 CIF
HKL
Paper
C28 H16 F6 O2P 1 21/c 120.5435; 6.2569; 35.797
90; 106.649; 90
4408.4Sonina, Alina A.; Koskin, Igor P.; Sherin, Peter S.; Rybalova, Tatyana V.; Shundrina, Inna K.; Mostovich, Evgeny A.; Kazantsev, Maxim S.
Crystal packing control of a trifluoromethyl-substituted furan/phenylene co-oligomer
Acta Crystallographica Section B, 2018, 74
2108288 CIF
HKL
C6 H2 Cl4P 1 21/c 13.8682; 14.9766; 13.4758
90; 90.378; 90
780.67Bujak, Maciej
Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding
Acta Crystallographica Section B, 2018, 74, 458-466
2108289 CIF
HKL
C6 H2 Cl4P 1 21/c 13.79937; 14.8635; 13.3272
90; 89.674; 90
752.6Bujak, Maciej
Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding
Acta Crystallographica Section B, 2018, 74, 458-466
2108290 CIF
HKL
C6 H2 Cl4P 1 21/c 13.83433; 23.9377; 17.2355
90; 94.293; 90
1577.52Bujak, Maciej
Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding
Acta Crystallographica Section B, 2018, 74, 458-466
2108291 CIF
HKL
C6 H2 Cl4P 1 21/c 13.76927; 23.6053; 17.174
90; 94.902; 90
1522.46Bujak, Maciej
Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding
Acta Crystallographica Section B, 2018, 74, 458-466
2108292 CIF
HKL
C12 H24 Ca O15P 21 21 216.71198; 13.3641; 19.5439
90; 90; 90
1753.08Bugris, V.; Dudás, Cs.; Kutus, B.; Harmat, V.; Csankó, K.; Brockhauser, S.; Pálinkó, I.; Turner, Peter; Sipos, P.
Crystal and solution structures of calcium complexes relevant to problematic waste disposal: calcium gluconate and calcium isosaccharinate
Acta Crystallographica Section B, 2018, 74
2108293 CIF
HKL
C12 H22 Ca O12P 21 21 26.7573; 19.5874; 5.7344
90; 90; 90
758.99Bugris, V.; Dudás, Cs.; Kutus, B.; Harmat, V.; Csankó, K.; Brockhauser, S.; Pálinkó, I.; Turner, Peter; Sipos, P.
Crystal and solution structures of calcium complexes relevant to problematic waste disposal: calcium gluconate and calcium isosaccharinate
Acta Crystallographica Section B, 2018, 74
2108294 CIFC13 H11 N3 O2P 1 21/c 18.4553; 10.1812; 13.408
90; 98.646; 90
1141.1Berger, 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 CIFC13 H13 N3 O3P b c a7.0488; 12.15; 28.649
90; 90; 90
2453.6Berger, 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 OP -110.0223; 11.1984; 12.4505
109.836; 101.25; 97.494
1259.58Berger, 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 CIFC15 H11 I N4I 4115.0197; 15.0197; 12.8791
90; 90; 90
2905.41Berger, 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 CIFC15 H11 Br N4P 1 21/c 114.8761; 4.0269; 23.183
90; 105.81; 90
1336.23Berger, 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 CIFC16 H14 Cl2 N4 OP 1 21/c 19.51859; 15.70955; 21.6869
90; 98.0651; 90
3210.83Berger, 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 CIFC13 H10 Br N3 OP 1 21/c 118.763; 6.5126; 10.1237
90; 95.458; 90
1231.5Berger, 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 OP 1 21/c 14.7568; 19.9611; 13.4063
90; 98.457; 90
1259.1Mondal, 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 OP 1 21/n 14.808; 9.7371; 27.708
90; 91.735; 90
1296.6Mondal, 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 OP -14.8189; 9.4501; 14.0283
96.048; 93.4; 93.414
632.77Mondal, 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 OP c a 217.7658; 19.1333; 8.8369
90; 90; 90
1313.03Mondal, 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 OP 1 21/c 125.6147; 5.3354; 9.3918
90; 96.775; 90
1274.56Mondal, 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 OP -15.1563; 10.7617; 11.9075
99.948; 91.911; 102.379
633.98Mondal, 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 OP 1 21/c 19.445; 15.275; 18.954
90; 97.374; 90
2711.9Mondal, 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 OP 1 21/c 112.8325; 10.3856; 9.7379
90; 93.059; 90
1295.95Mondal, 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 OP 1 21/c 116.952; 5.2521; 28.76
90; 94.966; 90
2551Mondal, 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 OP 1 21/n 14.7992; 10.0208; 27.428
90; 91.755; 90
1318.44Mondal, 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 OP 1 21/n 14.8056; 27.8678; 9.8421
90; 94.227; 90
1314.48Mondal, 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 OP c a 217.8062; 19.3; 8.8433
90; 90; 90
1332.33Mondal, 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 OP 1 21 14.8588; 4.9939; 26.0286
90; 91.448; 90
631.37Mondal, 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 OP 1 21/c 113.018; 10.488; 9.7309
90; 94.432; 90
1324.6Mondal, 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 OP 1 21/c 116.9434; 5.2417; 29.141
90; 94.775; 90
2579.09Mondal, 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 OP 1 21/c 120.7974; 6.5752; 9.6889
90; 93.899; 90
1321.86Mondal, 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 OP 1 21/c 111.0022; 4.7359; 26.562
90; 97.636; 90
1371.7Mondal, 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 OP 1 21/c 120.584; 7.1797; 9.1451
90; 97.122; 90
1341.1Mondal, 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 OP c a 217.9499; 19.6384; 8.8397
90; 90; 90
1380.08Mondal, 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 OP 1 21/c 126.9793; 5.2899; 9.5068
90; 95.747; 90
1349.97Mondal, 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 OP 1 21 14.9085; 4.9644; 26.7593
90; 92.549; 90
651.42Mondal, 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 OP 1 21/c 113.292; 10.708; 9.762
90; 96.305; 90
1381Mondal, 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 OP 1 21/c 114.7689; 5.2518; 17.2537
90; 93.217; 90
1336.1Mondal, 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 SP -17.522; 8.11; 20.892
92.574; 98.836; 103.844
1218.3Peng, Bo; Wang, Jian-Rong; Mei, Xuefeng
Triamterene‒furosemide salt: structural aspects and physicochemical evaluation
Acta Crystallographica Section B, 2018, 74
2108325 CIFBa F2.8 Li O0.1P m -3 m3.9978; 3.9978; 3.9978
90; 90; 90
63.894Wiedemann, 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 CIFBa F2.8 Li O0.1P m -3 m4.0406; 4.0406; 4.0406
90; 90; 90
65.969Wiedemann, 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 CIFBa F2.8 Li O0.1P m -3 m4.0581; 4.0581; 4.0581
90; 90; 90
66.83Wiedemann, 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 CIFBa F2.8 Li O0.1P m -3 m4.0763; 4.0763; 4.0763
90; 90; 90
67.733Wiedemann, 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 CIFBa F2.8 Li O0.1P m -3 m3.997; 3.997; 3.997
90; 90; 90
63.86Wiedemann, 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 CIFC8 H16 Cu2 O10C 1 2/c 113.08438; 8.50319; 14.05022
90; 119.309; 90
1363.12Herich, 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 CIFC8 H16 Cr2 O10C 1 2/c 113.10149; 8.56324; 14.14837
90; 119.121; 90
1386.68Herich, 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

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