Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2108651 | CIF | C2 D12 O4 S | P 1 21/c 1 | 10.266194; 7.01113; 10.068968 90; 101.503; 90 | 710.183 | Fortes, A. D.; Ponsonby, J.; Kirichek, O.; García-Sakai, V. On the crystal structures and phase transitions of hydrates in the binary dimethyl sulfoxide‒water system Acta Crystallographica Section B, 2020, 76 |
| 2108652 | CIF HKL | Cl Na | F m -3 m | 5.6035; 5.6035; 5.6035 90; 90; 90 | 175.95 | Tsirelson, Vladimir; Stash, Adam Orbital-free quantum crystallography: view on forces in crystals Acta Crystallographica Section B, 2020, 76 |
| 2108653 | CIF | F120 Ga20 K60 | I 41/a :2 | 19.1124; 19.1124; 34.4165 90; 90; 90 | 12571.8 | King, Graham New examples of non-cooperative octahedral tilting in a double perovskite: phase transitions in K~3~GaF~6~ Acta Crystallographica Section B, 2020, 76 |
| 2108654 | CIF | F30 Ga5 K15 | I 4/m | 13.6088; 13.6088; 8.6764 90; 90; 90 | 1606.86 | King, Graham New examples of non-cooperative octahedral tilting in a double perovskite: phase transitions in K~3~GaF~6~ Acta Crystallographica Section B, 2020, 76 |
| 2108655 | CIF | F6 Ga K3 | F m -3 m | 8.6649; 8.6649; 8.6649 90; 90; 90 | 650.565 | King, Graham New examples of non-cooperative octahedral tilting in a double perovskite: phase transitions in K~3~GaF~6~ Acta Crystallographica Section B, 2020, 76 |
| 2108656 | CIF HKL | C29 H20 Br3 Mn O4 P2 S | C 1 2 1 | 15.366; 16.035; 14.327 90; 91.21; 90 | 3529.3 | Van der Maelen, Juan F.; Ceroni, Mario; Ruiz, Javier The X-ray constrained wavefunction of the [Mn(CO)~4~{(C~6~H~5~)~2~P-S-C(Br~2~)-P(C~6~H~5~)~2~}]Br complex: a theoretical and experimental study of dihalogen bonds and other noncovalent interactions Acta Crystallographica Section B, 2020, 76 |
| 2108657 | CIF HKL Paper | C260 H264 N24 O40 | I 4 2 2 | 21.91; 21.91; 25.44 90; 90; 90 | 12212 | Gilski, Miroslaw; Bernatowicz, Piotr; Sakowicz, Arkadiusz; Szymański, Marek P.; Zalewska, Aldona; Szumna, Agnieszka; Jaskólski, Mariusz C~60~ in a peptidic cage: a case of symmetry mismatch studied by crystallography and solid-state NMR Acta Crystallographica Section B, 2020, 76 |
| 2108658 | CIF HKL | C15 H18 N2 O4 | C 1 2/c 1 | 12.741; 7.7542; 29.3961 90; 98.6; 90 | 2871.57 | Mali, Bhupendra P.; Dash, Soumya Ranjan; Nikam, Shrikant B.; Puthuvakkal, Anisha; Vanka, Kumar; Manoj, Kochunnoonny; Gonnade, Rajesh G. Five concomitant polymorphs of a green fluorescent protein chromophore (GFPc) analogue: understanding variations in photoluminescence with π-stacking interactions Acta Crystallographica Section B, 2020, 76 |
| 2108659 | CIF HKL | C15 H18 N2 O4 | P 1 21/c 1 | 7.3324; 29.277; 7.4171 90; 117.402; 90 | 1413.6 | Mali, Bhupendra P.; Dash, Soumya Ranjan; Nikam, Shrikant B.; Puthuvakkal, Anisha; Vanka, Kumar; Manoj, Kochunnoonny; Gonnade, Rajesh G. Five concomitant polymorphs of a green fluorescent protein chromophore (GFPc) analogue: understanding variations in photoluminescence with π-stacking interactions Acta Crystallographica Section B, 2020, 76 |
| 2108660 | CIF HKL | C15 H18 N2 O4 | P -1 | 7.119; 7.2678; 15.0171 78.012; 82.182; 66.007 | 693.2 | Mali, Bhupendra P.; Dash, Soumya Ranjan; Nikam, Shrikant B.; Puthuvakkal, Anisha; Vanka, Kumar; Manoj, Kochunnoonny; Gonnade, Rajesh G. Five concomitant polymorphs of a green fluorescent protein chromophore (GFPc) analogue: understanding variations in photoluminescence with π-stacking interactions Acta Crystallographica Section B, 2020, 76 |
| 2108661 | CIF HKL | C15 H18 N2 O4 | P 1 21/c 1 | 7.3901; 25.1748; 8.0438 90; 108.992; 90 | 1415.04 | Mali, Bhupendra P.; Dash, Soumya Ranjan; Nikam, Shrikant B.; Puthuvakkal, Anisha; Vanka, Kumar; Manoj, Kochunnoonny; Gonnade, Rajesh G. Five concomitant polymorphs of a green fluorescent protein chromophore (GFPc) analogue: understanding variations in photoluminescence with π-stacking interactions Acta Crystallographica Section B, 2020, 76 |
| 2108662 | CIF HKL | C15 H18 N2 O4 | P -1 | 13.1277; 13.977; 17.802 80.629; 82.485; 62.419 | 2850.8 | Mali, Bhupendra P.; Dash, Soumya Ranjan; Nikam, Shrikant B.; Puthuvakkal, Anisha; Vanka, Kumar; Manoj, Kochunnoonny; Gonnade, Rajesh G. Five concomitant polymorphs of a green fluorescent protein chromophore (GFPc) analogue: understanding variations in photoluminescence with π-stacking interactions Acta Crystallographica Section B, 2020, 76 |
| 2108663 | CIF HKL | Cl10 H20 Li4 O11 Ru2 | P -1 | 8.0548; 10.7806; 13.7195 78.551; 80.825; 72.1629 | 1105.28 | Mudiyanselage, Ranuri S Dissanayaka; Marshall, Madalynn; Kong, Tai; Xie, Weiwei Li~4~Ru~2~OCl~10~·10H~2~O: crystal structure, magnetic properties and bonding interactions in ruthenium-oxo complexes Acta Crystallographica Section B, 2020, 76 |
| 2108664 | CIF HKL | K3 Mo6 Na Ni4 O24 | R -3 c :H | 14.279; 14.279; 19.7589 90; 90; 120 | 3488.9 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108665 | CIF HKL | K2.51 Mo6 Na1.49 Ni4 O24 | R -3 c :H | 14.2719; 14.2719; 19.8063 90; 90; 120 | 3493.8 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108666 | CIF HKL | K3 Mg4 Mo6 Na O24 | R -3 c :H | 14.4528; 14.4528; 19.8894 90; 90; 120 | 3597.96 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108667 | CIF HKL | K2.88 Mg4 Mo6 Na1.12 O24 | R -3 c :H | 14.4673; 14.4673; 19.9186 90; 90; 120 | 3610.5 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108668 | CIF HKL | Co4 K3 Mo6 Na O24 | R -3 c :H | 14.4638; 14.4638; 19.8369 90; 90; 120 | 3593.93 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108669 | CIF HKL | K3.11 Li0.89 Mg4 Mo6 O24 | R -3 c :H | 14.3541; 14.3541; 19.7338 90; 90; 120 | 3521.22 | Gulyaeva, Oksana A.; Solodovnikova, Zoya A.; Solodovnikov, Sergey F.; Zolotova, Evgeniya S.; Mateyshina, Yuliya G.; Uvarov, Nikolai F. Triple molybdates K~3{‒~<i>x</i>}Na~1+<i>x~</i><i>M</i>~4~(MoO~4~)~6~ (<i>M</i>~= Ni, Mg, Co) and K~3+<i>x~</i>Li~1{‒~<i>x</i>}Mg~4~(MoO~4~)~6~ isotypic with II-Na~3~Fe~2~(AsO~4~)~3~ and yurmarinite: synthesis, potassium disorder, crystal chemistry and ionic conductivity Acta Crystallographica Section B, 2020, 76 |
| 2108670 | CIF Paper | C3 H8 N2 O6 P2 | P n n a | 7.014; 8.361; 14.389 90; 90; 90 | 843.8 | Budzikur, Daria; Szklarz, Przemysław; Kinzhybalo, Vasyl; Ślepokura, Katarzyna A. Crystal structures and phase transitions of imidazolium hypodiphosphates Acta Crystallographica Section B, 2020, 76 |
| 2108671 | CIF HKL Paper | C3 H8 N2 O6 P2 | P n n a | 6.962; 8.368; 14.388 90; 90; 90 | 838.2 | Budzikur, Daria; Szklarz, Przemysław; Kinzhybalo, Vasyl; Ślepokura, Katarzyna A. Crystal structures and phase transitions of imidazolium hypodiphosphates Acta Crystallographica Section B, 2020, 76 |
| 2108672 | CIF HKL Paper | C3 H8 N2 O6 P2 | P 21/n 1 1 | 13.673; 8.396; 14.317 90.57; 90; 90 | 1643.5 | Budzikur, Daria; Szklarz, Przemysław; Kinzhybalo, Vasyl; Ślepokura, Katarzyna A. Crystal structures and phase transitions of imidazolium hypodiphosphates Acta Crystallographica Section B, 2020, 76 |
| 2108673 | CIF HKL Paper | C6 H12 N4 O6 P2 | P 43 21 2 | 8.966; 8.966; 15.462 90; 90; 90 | 1243 | Budzikur, Daria; Szklarz, Przemysław; Kinzhybalo, Vasyl; Ślepokura, Katarzyna A. Crystal structures and phase transitions of imidazolium hypodiphosphates Acta Crystallographica Section B, 2020, 76 |
| 2108674 | CIF HKL | C23 H26 F N3 O6 | P 1 21 1 | 6.49617; 7.41888; 23.587 90; 92.9418; 90 | 1135.26 | Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J. Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties Acta Crystallographica Section B, 2020, 76 |
| 2108675 | CIF HKL | C23 H28 F N3 O8 | P 21 21 21 | 6.428; 6.987; 52.001 90; 90; 90 | 2335.5 | Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J. Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties Acta Crystallographica Section B, 2020, 76 |
| 2108676 | CIF | C23 H26 F N3 O8 | P 21 21 21 | 4.7535; 15.801; 29.855 90; 90; 90 | 2242.41 | Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J. Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties Acta Crystallographica Section B, 2020, 76 |
| 2108677 | CIF HKL | C46 H54.5 F2 N6 O17.25 | P 21 21 2 | 30.3989; 16.1024; 9.66944 90; 90; 90 | 4733.14 | Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J. Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties Acta Crystallographica Section B, 2020, 76 |
| 2108678 | CIF HKL | C23 H28 F N3 O10 | P 1 21 1 | 16.78184; 15.47624; 19.5982 90; 105.758; 90 | 4898.74 | Khalaji, Mehrnaz; Wróblewska, Aneta; Wielgus, Ewelina; Bujacz, Grzegorz D.; Dudek, Marta K.; Potrzebowski, Marek J. Structural variety of heterosynthons in linezolid cocrystals with modified thermal properties Acta Crystallographica Section B, 2020, 76 |
| 2108679 | CIF | Cu Ge9 O24 Sr5 | P 1 2/c 1 | 11.8817; 8.19277; 10.3237 90; 101.597; 90 | 984.43 | Klein, Holger; Kodjikian, Stéphanie; Philippe, Rémy; Ding, Lei; Colin, Claire V.; Darie, Céline; Bordet, Pierre Three different Ge environments in a new Sr~5~CuGe~9~O~24~ phase synthesized at high pressure and high temperature Acta Crystallographica Section B, 2020, 76, 727-732 |
| 2108680 | CIF HKL Paper | C12 H13 N O8 | P 21 21 2 | 29.1612; 9.207; 4.7387 90; 90; 90 | 1272.28 | Evtushenko, Diana N.; Arkhipov, Sergey G.; Fateev, Alexander V.; Izaak, Tatyana I.; Egorova, Lidia A.; Skorik, Nina A.; Vodyankina, Olga V.; Boldyreva, Elena V. A cocrystal of <small>L</small>-ascorbic acid with picolinic acid: the role of O—H···O, N—H···O and C—H···O hydrogen bonds and <small>L</small>-ascorbic acid conformation in structure stabilization Acta Crystallographica Section B, 2020, 76 |
| 2108681 | CIF HKL | C12 H13 N O8 | P 21 21 2 | 29.0583; 9.15479; 4.70223 90; 90; 90 | 1250.9 | Evtushenko, Diana N.; Arkhipov, Sergey G.; Fateev, Alexander V.; Izaak, Tatyana I.; Egorova, Lidia A.; Skorik, Nina A.; Vodyankina, Olga V.; Boldyreva, Elena V. A cocrystal of <small>L</small>-ascorbic acid with picolinic acid: the role of O—H···O, N—H···O and C—H···O hydrogen bonds and <small>L</small>-ascorbic acid conformation in structure stabilization Acta Crystallographica Section B, 2020, 76 |
| 2108682 | CIF HKL | C16 H12 O12 Zn2 | C 1 2/c 1 | 16.1681; 16.261; 13.7893 90; 110.508; 90 | 3395.6 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108683 | CIF HKL | C28 H20 N4 O11 Zn2 | P -1 | 10.07; 12.144; 14.172 104.63; 105.637; 109.156 | 1461.6 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108684 | CIF HKL | C26 H20 N2 O12 Zn2 | P -1 | 7.8759; 8.0318; 20.59 86.441; 88.986; 72.182 | 1237.6 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108685 | CIF HKL | C28 H14 Cd2 N2 O9 | P -1 | 11.2042; 11.2728; 11.7208 109.537; 97.561; 110.368 | 1255.34 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108686 | CIF HKL | C26 H18 N2 Ni2 O11 | P -1 | 9.2229; 12.2226; 13.073 112.261; 106.134; 97.765 | 1261.3 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108687 | CIF HKL | C128 H85 Co4 N12 O18 | P 1 21/c 1 | 31.055; 23.792; 16.54 90; 94.255; 90 | 12187 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108688 | CIF HKL | C48 H32 Co2 N4 O10 | P -1 | 12.068; 14.523; 14.662 68.654; 79.061; 75.13 | 2300 | Zhang, Xiaoyu; Yang, Qinglin; Yun, Meng; Si, Changdai; An, Ning; Jia, Meimei; Liu, Jiacheng; Dong, Xiuyan Seven new metal‒organic frameworks assembled from semi-rigid polycarboxylate and auxiliary N-donor ligands: syntheses, structures and properties Acta Crystallographica Section B, 2020, 76 |
| 2108689 | CIF | C26 H33 N O2 | P 21 21 21 | 7.4313; 9.6383; 29.8978 90; 90; 90 | 2141.43 | Korlyukov, Alexander A.; Vologzhanina, Anna V.; Trzybinski, Damian; Malinska, Maura; Wozniak, Krzysztof Charge density analysis of abiraterone acetate Acta Crystallographica Section B, 2020, 76 |
| 2108690 | CIF HKL | C26 H33 N O2 | P 21 21 21 | 7.4313; 9.6383; 29.8978 90; 90; 90 | 2141.43 | Korlyukov, Alexander A.; Vologzhanina, Anna V.; Trzybinski, Damian; Malinska, Maura; Wozniak, Krzysztof Charge density analysis of abiraterone acetate Acta Crystallographica Section B, 2020, 76 |
| 2108691 | CIF HKL | B Bi4 I O7 | I m m m | 3.959; 13.453; 3.969 90; 90; 90 | 211.39 | Volkov, Sergey; Bubnova, Rimma; Krzhizhanovskaya, Maria; Galafutnik, Lydia The first bismuth borate oxyiodide, Bi~4~BO~7~I: commensurate or incommensurate? Acta Crystallographica Section B, 2020, 76 |
| 2108692 | CIF | Ca0.1 Fe La0.9 O3 | P n m a | 5.558528; 7.837216; 5.547272 90; 90; 90 | 241.658 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108693 | CIF | Ca0.4 Fe La0.6 O3 | P n m a | 5.506428; 7.77618; 5.529845 90; 90; 90 | 236.782 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108694 | CIF | Ca0.1 Fe Nd0.9 O3 | P n m a | 5.568011; 7.756535; 5.451495 90; 90; 90 | 235.442 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108695 | CIF | Ca0.4 Fe Nd0.6 O3 | P n m a | 5.533425; 7.725984; 5.448728 90; 90; 90 | 232.939 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108696 | CIF | Ca0.12 Fe La0.88 O3 | P 1 | 7.860187; 7.839117; 7.860187 90; 89.7476; 90 | 484.316 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108697 | CIF | Ca0.5 Fe La0.5 O3 | P -1 | 5.570218; 7.839117; 5.545738 90; 90; 90 | 242.158 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108698 | CIF | Ca0.12 Fe Nd0.88 O3 | P 1 | 7.793071; 7.757502; 7.793071 90; 88.7865; 90 | 471.023 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108699 | CIF | Ca0.5 Fe Nd0.5 O3 | P -1 | 5.56858; 7.757502; 5.451869 90; 90; 90 | 235.511 | Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles Acta Crystallographica Section B, 2020, 76 |
| 2108700 | CIF HKL | La Te1.933 | P 4/n m m :1 | 4.5226; 4.5226; 9.147 90; 90; 90 | 187.09 | Poddig, Hagen; Doert, Thomas Distorted Te nets in the modulated crystal structures of <i>RE</i>Te~1.94(1)~ (<i>RE</i> = La, Pr, Nd) Acta Crystallographica Section B, 2020, 76 |
| 2108701 | CIF HKL | Pr Te1.942 | P 4/n m m :1 | 4.4535; 4.4535; 9.047 90; 90; 90 | 179.44 | Poddig, Hagen; Doert, Thomas Distorted Te nets in the modulated crystal structures of <i>RE</i>Te~1.94(1)~ (<i>RE</i> = La, Pr, Nd) Acta Crystallographica Section B, 2020, 76 |
| 2108702 | CIF HKL | Nd Te1.923 | P 4/n m m :1 | 4.4274; 4.4274; 9.029 90; 90; 90 | 176.99 | Poddig, Hagen; Doert, Thomas Distorted Te nets in the modulated crystal structures of <i>RE</i>Te~1.94(1)~ (<i>RE</i> = La, Pr, Nd) Acta Crystallographica Section B, 2020, 76 |
| 2108703 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 8.1016; 18.473; 9.04 90; 95.91; 90 | 1346 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108704 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 8.089; 18.4614; 9.074 90; 96.08; 90 | 1347.4 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108705 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 8.053; 18.47; 9.044 90; 95.4; 90 | 1339 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108706 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.982; 18.318; 8.964 90; 95.08; 90 | 1305.5 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108707 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.965; 18.251; 8.929 90; 94.85; 90 | 1293.4 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108708 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.918; 18.223; 8.897 90; 94.6; 90 | 1280 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108709 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.897; 18.1579; 8.874 90; 94.54; 90 | 1268.5 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108710 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.8356; 18.074; 8.88 90; 94.24; 90 | 1254 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108711 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.84; 18.094; 8.82 90; 94.13; 90 | 1248 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108712 | CIF HKL | C5 H3 N7 | P 1 21/c 1 | 7.7755; 18.017; 8.75 90; 93.53; 90 | 1223 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108713 | CIF HKL | C6 H5 N7 O0.3 | I 41/a :2 | 28.1674; 28.1674; 4.15209 90; 90; 90 | 3294.28 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108714 | CIF | C6 H5 N7 O0.4 | I 41/a :2 | 28.1659; 28.1659; 4.12335 90; 90; 90 | 3271.13 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108715 | CIF HKL | C6 H5 N7 O0.4 | I 41/a :2 | 28.1314; 28.1314; 4.09378 90; 90; 90 | 3239.72 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108716 | CIF HKL | C6 H5 N7 O0.4 | I 41/a :2 | 28.1081; 28.1081; 4.06918 90; 90; 90 | 3214.92 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108717 | CIF HKL | C6 H5 N7 O0.4 | I 41/a :2 | 28.0757; 28.0757; 4.04859 90; 90; 90 | 3191.28 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108718 | CIF | C6 H5 N7 O0.5 | I 41/a :2 | 28.275; 28.275; 4.1124 90; 90; 90 | 3287.8 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108719 | CIF | C6 H5 N7 O0.6 | I 41/a :2 | 28.18; 28.18; 4.0701 90; 90; 90 | 3232.1 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108720 | CIF | C6 H5 N7 O0.5 | I 41/a :2 | 27.972; 27.972; 3.9991 90; 90; 90 | 3129 | Olejniczak, Anna; Katrusiak, Anna; Podsiadło, Marcin; Katrusiak, Andrzej Crystal design by CH···N and N···N interactions: high-pressure structures of high-nitrogen-content azido-triazolopyridazines compounds Acta Crystallographica Section B, 2020, 76 |
| 2108721 | CIF HKL Paper | C25 H34 O2 S | P c a 21 | 54.285; 5.5843; 14.8411 90; 90; 90 | 4499 | Deptuch, Aleksandra; Jaworska-Gołab, Teresa; Kusz, Joachim; Ksiażek, Maria; Nagao, Keigo; Matsumoto, Takashi; Yamano, Akihito; Ossowska-Chruściel, Mirosława D.; Chruściel, Janusz; Marzec, Monika Single crystal X-ray structure determination and temperature-dependent structural studies of the smectogenic compound 7OS5 Acta Crystallographica Section B, 2020, 76 |
| 2108722 | CIF HKL | B12 Yb | F m -3 m | 7.4598; 7.4598; 7.4598 90; 90; 90 | 415.128 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108723 | CIF HKL | B12 Yb | F m -3 m | 7.46; 7.46; 7.46 90; 90; 90 | 415.161 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108724 | CIF HKL | B12 Yb | F m -3 m | 7.4602; 7.4602; 7.4602 90; 90; 90 | 415.194 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108725 | CIF HKL | B12 Yb | F m -3 m | 7.4603; 7.4603; 7.4603 90; 90; 90 | 415.211 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108726 | CIF HKL | B12 Yb | F m -3 m | 7.4584; 7.4584; 7.4584 90; 90; 90 | 414.89 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108727 | CIF HKL | B12 Yb | F m -3 m | 7.4585; 7.4585; 7.4585 90; 90; 90 | 414.911 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108728 | CIF HKL | B12 Yb | F m -3 m | 7.4599; 7.4599; 7.4599 90; 90; 90 | 415.144 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108729 | CIF HKL | B12 Yb | F m -3 m | 7.4608; 7.4608; 7.4608 90; 90; 90 | 415.295 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108730 | CIF HKL | B12 Yb | F m -3 m | 7.4629; 7.4629; 7.4629 90; 90; 90 | 415.645 | Bolotina, Nadezhda; Khrykina, Olga; Azarevich, Andrey; Gavrilkin, Sergey; Sluchanko, Nikolay Fine details of crystal structure and atomic vibrations in YbB~12~ with a metal‒insulator transition Acta Crystallographica Section B, 2020, 76 |
| 2108731 | CIF HKL | C10 H11 N O3 | P 21 21 21 | 5.1732; 8.286; 22.264 90; 90; 90 | 954.3 | Guillén, Marilia; Mora, Asiloé J.; Belandria, Lusbely M.; Seijas, Luis E.; Ramírez, Jeans W.; Burgos, José L.; Rincón, Luis; Delgado, Gerzon E. Two conformational polymorphs of 4-methylhippuric acid Acta Crystallographica Section B, 2020, 76 |
| 2108732 | CIF HKL | C10 H11 N O3 | P 1 21/c 1 | 9.59; 8.67; 23.811 90; 94.364; 90 | 1974 | Guillén, Marilia; Mora, Asiloé J.; Belandria, Lusbely M.; Seijas, Luis E.; Ramírez, Jeans W.; Burgos, José L.; Rincón, Luis; Delgado, Gerzon E. Two conformational polymorphs of 4-methylhippuric acid Acta Crystallographica Section B, 2020, 76 |
| 2108733 | CIF HKL | C23 H26 N4 O S | P -1 | 9.4054; 10.4228; 11.9607 96.683; 95.288; 104.474 | 1118.59 | Andrusenko, Iryna; Potticary, Jason; Hall, Simon R.; Gemmi, Mauro A new olanzapine cocrystal obtained from volatile deep eutectic solvents and determined by 3D electron diffraction Acta Crystallographica Section B, 2020, 76 |
| 2108734 | CIF | C23 H26 N4 O S | P -1 | 9.4051; 10.4236; 11.9619 96.686; 95.2878; 104.474 | 1118.74 | Andrusenko, Iryna; Potticary, Jason; Hall, Simon R.; Gemmi, Mauro A new olanzapine cocrystal obtained from volatile deep eutectic solvents and determined by 3D electron diffraction Acta Crystallographica Section B, 2020, 76 |
| 2108735 | CIF HKL | Ag3.06 O12 P3 Sc2 | C 1 2/c 1 | 15.467; 8.9627; 9.1186 90; 124.144; 90 | 1046.2 | Redhammer, Günther J.; Tippelt, Gerold; Stahl, Quirin; Benisek, Artur; Rettenwander, Daniel Study on the structural phase transitions in NaSICON-type compounds using Ag~3~Sc~2~(PO~4~)~3~ as a model system Acta Crystallographica Section B, 2021, 77, 10-22 |
| 2108736 | CIF HKL | Ag3.03 O12 P2 Sc2 | C 1 2/c 1 | 15.5374; 8.9703; 22.5718 90; 89.9984; 90 | 3145.95 | Redhammer, Günther J.; Tippelt, Gerold; Stahl, Quirin; Benisek, Artur; Rettenwander, Daniel Study on the structural phase transitions in NaSICON-type compounds using Ag~3~Sc~2~(PO~4~)~3~ as a model system Acta Crystallographica Section B, 2021, 77, 10-22 |
| 2108737 | CIF HKL | Ag3.05 O12 P3 Sc2 | R -3 c :H | 8.9756; 8.9756; 22.6248 90; 90; 120 | 1578.49 | Redhammer, Günther J.; Tippelt, Gerold; Stahl, Quirin; Benisek, Artur; Rettenwander, Daniel Study on the structural phase transitions in NaSICON-type compounds using Ag~3~Sc~2~(PO~4~)~3~ as a model system Acta Crystallographica Section B, 2021, 77, 10-22 |
| 2108738 | CIF HKL | Ag3.02 O12 P3 Sc2 | R -3 c :H | 8.9671; 8.9671; 22.7622 90; 90; 120 | 1585.1 | Redhammer, Günther J.; Tippelt, Gerold; Stahl, Quirin; Benisek, Artur; Rettenwander, Daniel Study on the structural phase transitions in NaSICON-type compounds using Ag~3~Sc~2~(PO~4~)~3~ as a model system Acta Crystallographica Section B, 2021, 77, 10-22 |
| 2108739 | CIF HKL | C18 H10 Cl2 O2 S2 | P 1 21/c 1 | 4.6455; 15.9427; 10.1908 90; 95.846; 90 | 750.82 | Sakthidharan, C. P.; Niewa, R.; Zherebtsov, D. A.; Podgornov, F. V.; Matveychuk, Y. V.; Bartashevich, E. V.; Nayfert, S. A.; Adonin, S. A.; Gavrilyak, M. V.; Boronin, V. A.; Polozov, M. A.; Karthikeyan, S.; Sarojadevi, M.; Rajakumar, K.; Prabunathan, P. Crystal structures and dielectric properties of 4,4'-dimethyl-6,6'-dichlorothioindigo (Pigment Red 181) Acta Crystallographica Section B, 2021, 77, 23-30 |
| 2108740 | CIF HKL | C18 H10 Cl2 O2 S2 | P -1 | 3.8612; 8.8249; 11.2319 94.972; 92.244; 90.968 | 380.91 | Sakthidharan, C. P.; Niewa, R.; Zherebtsov, D. A.; Podgornov, F. V.; Matveychuk, Y. V.; Bartashevich, E. V.; Nayfert, S. A.; Adonin, S. A.; Gavrilyak, M. V.; Boronin, V. A.; Polozov, M. A.; Karthikeyan, S.; Sarojadevi, M.; Rajakumar, K.; Prabunathan, P. Crystal structures and dielectric properties of 4,4'-dimethyl-6,6'-dichlorothioindigo (Pigment Red 181) Acta Crystallographica Section B, 2021, 77, 23-30 |
| 2108741 | CIF HKL | C32 H27 F3 N4 O3 | P -1 | 5.2419; 15.0825; 18.4638 103.874; 93.756; 97.404 | 1398.3 | Schneider-Rauber, Gabriela; Arhangelskis, Mihails; Bond, Andrew D.; Ho, Raimundo; Nere, Nandkishor; Bordawekar, Shailendra; Sheikh, Ahmad Y.; Jones, William Polymorphism and surface diversity arising from stress-induced transformations ‒ the case of multicomponent forms of carbamazepine Acta Crystallographica Section B, 2021, 77, 54-67 |
| 2108742 | CIF HKL Paper | C7.5 H10 N3 O4 | P -1 | 6.905; 8.394; 9.339 117.56; 102.07; 89.39 | 466.94 | Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Pietraszko, Adam; Hilczer, Bożena Effect of disordered imidazole substructure on proton dynamics in imidazolium malonic acid salt Acta Crystallographica Section B, 2021, 77, 31-40 |
| 2108743 | CIF HKL | C7.5 H10 N3 O4 | P -1 | 6.999; 8.378; 9.249 116.22; 101.88; 91.18 | 472.3 | Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Pietraszko, Adam; Hilczer, Bożena Effect of disordered imidazole substructure on proton dynamics in imidazolium malonic acid salt Acta Crystallographica Section B, 2021, 77, 31-40 |
| 2108744 | CIF HKL | C7.5 H10 N3 O4 | P -1 | 6.98; 8.4; 9.23 116.4; 101.57; 91.09 | 471.3 | Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Pietraszko, Adam; Hilczer, Bożena Effect of disordered imidazole substructure on proton dynamics in imidazolium malonic acid salt Acta Crystallographica Section B, 2021, 77, 31-40 |
| 2108745 | CIF HKL | C7.5 H10 N3 O4 | P -1 | 7.295; 8.28; 9.249 115.79; 103.12; 91.91 | 484.3 | Ławniczak, Paweł; Pogorzelec-Glaser, Katarzyna; Pietraszko, Adam; Hilczer, Bożena Effect of disordered imidazole substructure on proton dynamics in imidazolium malonic acid salt Acta Crystallographica Section B, 2021, 77, 31-40 |
| 2108746 | CIF HKL Paper | C30 H36 Co Mo8 N7 O30 | P 1 21/c 1 | 19.27; 10.993; 23.917 90; 107.517; 90 | 4831.5 | Atencio, Reinaldo; Briceño, Alexander; Bruno-Colmenarez, Julia; Silva, Pedro; Rodríguez, Laura; Sosa, Eleida; Limones, Erick; Pacheco, Yesenia; Cáceres, Julio; Vielma, Joel Concomitance of octamolybdate isomers in metastable crystal structures isolated using homoleptic Co^II^/Co^III^ complexes as structure-directing templates Acta Crystallographica Section B, 2021, 77, 99-114 |
| 2108747 | CIF HKL Paper | C60 H72 Co2 Mo12 N12 O51 | P 1 21/n 1 | 11.151; 21.972; 37.57 90; 97.218; 90 | 9132 | Atencio, Reinaldo; Briceño, Alexander; Bruno-Colmenarez, Julia; Silva, Pedro; Rodríguez, Laura; Sosa, Eleida; Limones, Erick; Pacheco, Yesenia; Cáceres, Julio; Vielma, Joel Concomitance of octamolybdate isomers in metastable crystal structures isolated using homoleptic Co^II^/Co^III^ complexes as structure-directing templates Acta Crystallographica Section B, 2021, 77, 99-114 |
| 2108748 | CIF HKL Paper | C20 H16 Co Mo4 N4 O13 | P 1 21/n 1 | 10.053; 16.408; 15.749 90; 100.06; 90 | 2557.9 | Atencio, Reinaldo; Briceño, Alexander; Bruno-Colmenarez, Julia; Silva, Pedro; Rodríguez, Laura; Sosa, Eleida; Limones, Erick; Pacheco, Yesenia; Cáceres, Julio; Vielma, Joel Concomitance of octamolybdate isomers in metastable crystal structures isolated using homoleptic Co^II^/Co^III^ complexes as structure-directing templates Acta Crystallographica Section B, 2021, 77, 99-114 |
| 2108749 | CIF HKL | C2 H5 Na O | P -4 21 m | 4.41084; 4.41084; 9.06779 90; 90; 90 | 176.418 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108750 | CIF HKL | C6 H17 Na O3 | P 1 21/n 1 | 11.622; 5.1926; 17.682 90; 104.08; 90 | 1035 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108751 | CIF HKL | C3 H7 Na O | P 4/n m m :2 | 4.38439; 4.38439; 12.1431 90; 90; 90 | 233.425 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108752 | CIF HKL | C4 H9 Na O | P 4/n m m :2 | 4.43232; 4.43232; 14.0143 90; 90; 90 | 275.317 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108753 | CIF HKL | C5 H11 Na O | P 4/n m m :2 | 4.4084; 4.4084; 16.9376 90; 90; 90 | 329.17 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108754 | CIF HKL | C18 H47 Na O6 | C 1 2/c 1 | 21.2073; 17.1307; 17.825 90; 123.871; 90 | 5376.8 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108755 | CIF HKL | C9 H23 Na O3 | C 1 2/c 1 | 23.745; 5.075; 24.174 90; 111.589; 90 | 2708.7 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108756 | CIF | C10 H23 Na O2 | P 1 21/c 1 | 10.126; 6.0299; 20.6944 90; 104.16; 90 | 1225.18 | Beske, Maurice; Cronje, Stephanie; Schmidt, Martin U.; Tapmeyer, Lukas Disordered sodium alkoxides from powder data: crystal structures of sodium ethoxide, propoxide, butoxide and pentoxide, and some of their solvates Acta Crystallographica Section B, 2021, 77 |
| 2108757 | CIF HKL | C10 H11 N O3 | P 1 21/c 1 | 8.6896; 10.891; 9.596 90; 90.075; 90 | 908.15 | Wanat, Monika; Malinska, Maura; Gutmann, Matthias J.; Cooper, Richard I.; Wozniak, Krzysztof HAR, TAAM and BODD refinements of model crystal structures using Cu~<i>K</i>α and Mo~<i>K</i>α X-ray diffraction data Acta Crystallographica Section B, 2021, 77 |
| 2108758 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.2707; 8.9022; 8.9217 90; 90; 90 | 656.88 | Wanat, Monika; Malinska, Maura; Gutmann, Matthias J.; Cooper, Richard I.; Wozniak, Krzysztof HAR, TAAM and BODD refinements of model crystal structures using Cu~<i>K</i>α and Mo~<i>K</i>α X-ray diffraction data Acta Crystallographica Section B, 2021, 77 |
| 2108759 | CIF HKL | C5 H6 N2 O2 | I b a m | 13.17921; 13.20059; 6.21502 90; 90; 90 | 1081.25 | Wanat, Monika; Malinska, Maura; Gutmann, Matthias J.; Cooper, Richard I.; Wozniak, Krzysztof HAR, TAAM and BODD refinements of model crystal structures using Cu~<i>K</i>α and Mo~<i>K</i>α X-ray diffraction data Acta Crystallographica Section B, 2021, 77 |
| 2108760 | CIF HKL | C5 H6 N2 O2 | I b a m | 13.1643; 13.184; 6.2067 90; 90; 90 | 1077.22 | Wanat, Monika; Malinska, Maura; Gutmann, Matthias J.; Cooper, Richard I.; Wozniak, Krzysztof HAR, TAAM and BODD refinements of model crystal structures using Cu~<i>K</i>α and Mo~<i>K</i>α X-ray diffraction data Acta Crystallographica Section B, 2021, 77 |
| 2108761 | CIF | C10 H11 N O3 | P 1 21/c 1 | 8.6809; 10.8826; 9.6214 90; 90.15; 90 | 908.94 | Wanat, Monika; Malinska, Maura; Gutmann, Matthias J.; Cooper, Richard I.; Wozniak, Krzysztof HAR, TAAM and BODD refinements of model crystal structures using Cu~<i>K</i>α and Mo~<i>K</i>α X-ray diffraction data Acta Crystallographica Section B, 2021, 77 |
| 2108762 | CIF Paper | C16 H26 O6 | C 1 2 1 | 12.5887; 6.9; 18.2523 90; 107.227; 90 | 1514.31 | Savic, Viktor; Eder, Felix; Göb, Christian; Mihovilovic, Marko D.; Stanetty, Christian; Stöger, Berthold The role of hydrogen bonding in the incommensurate modulation of <i>myo</i>-inositol camphor ketal Acta Crystallographica Section B, 2021, 77 |
| 2108763 | CIF HKL | La3 Li6.27 O12 Ta1.09 Zr0.91 | I a -3 d | 12.8511; 12.8511; 12.8511 90; 90; 90 | 2122.37 | Redhammer, Günther J.; Meven, Martin; Ganschow, Steffen; Tippelt, Gerold; Rettenwander, Daniel Single-crystal neutron and X-ray diffraction study of garnet-type solid-state electrolyte Li~6~La~3~ZrTaO~12~: an <i>in situ</i> temperature-dependence investigation (2.5 {łeq} <i>T</i> {łeq} 873K) Acta Crystallographica Section B, 2021, 77, 123-130 |
| 2108764 | CIF HKL | La3 Li6.27 O12 Ta1.09 Zr0.91 | I a -3 d | 12.8592; 12.8592; 12.8592 90; 90; 90 | 2126.38 | Redhammer, Günther J.; Meven, Martin; Ganschow, Steffen; Tippelt, Gerold; Rettenwander, Daniel Single-crystal neutron and X-ray diffraction study of garnet-type solid-state electrolyte Li~6~La~3~ZrTaO~12~: an <i>in situ</i> temperature-dependence investigation (2.5 {łeq} <i>T</i> {łeq} 873K) Acta Crystallographica Section B, 2021, 77, 123-130 |
| 2108765 | CIF HKL | La3 Li6.27 O12 Ta1.09 Zr0.91 | I a -3 d | 12.8775; 12.8775; 12.8775 90; 90; 90 | 2135.48 | Redhammer, Günther J.; Meven, Martin; Ganschow, Steffen; Tippelt, Gerold; Rettenwander, Daniel Single-crystal neutron and X-ray diffraction study of garnet-type solid-state electrolyte Li~6~La~3~ZrTaO~12~: an <i>in situ</i> temperature-dependence investigation (2.5 {łeq} <i>T</i> {łeq} 873K) Acta Crystallographica Section B, 2021, 77, 123-130 |
| 2108766 | CIF HKL | La3 Li6.27 O12 Ta1.09 Zr0.91 | I a -3 d | 12.9051; 12.9051; 12.9051 90; 90; 90 | 2149.24 | Redhammer, Günther J.; Meven, Martin; Ganschow, Steffen; Tippelt, Gerold; Rettenwander, Daniel Single-crystal neutron and X-ray diffraction study of garnet-type solid-state electrolyte Li~6~La~3~ZrTaO~12~: an <i>in situ</i> temperature-dependence investigation (2.5 {łeq} <i>T</i> {łeq} 873K) Acta Crystallographica Section B, 2021, 77, 123-130 |
| 2108767 | CIF HKL | C14 H6 N6 O12 | C 1 2/c 1 | 21.221; 10.308; 19.4134 90; 129.087; 90 | 3296.17 | Liu, Yunzhang; Chen, Lizhen; Wang, Jianlong; Chen, Jun; Wang, Jingqi; Pan, Hongxia The crystal structure and thermal decomposition kinetics of <i>cis</i>-hexanitrostilbene Acta Crystallographica Section B, 2021, 77 |
| 2108768 | CIF HKL Paper | C34 H32 N8 Ni2 O8 S2 | P 1 21/c 1 | 9.9403; 11.5796; 16.0806 90; 101.178; 90 | 1815.84 | Feng, Tao; Li, Li-Li; Li, Ya-Juan; Dong, Wen-Kui A half-salamo-based pyridine-containing ligand and its novel Ni^II^ complexes including different auxiliary ligands: syntheses, structures, fluorescence properties, DFT calculations and Hirshfeld surface analysis Acta Crystallographica Section B, 2021, 77, 168-181 |
| 2108769 | CIF HKL Paper | C32 H32 N12 Ni2 O8 | P 1 21/n 1 | 11.6387; 10.0171; 14.794 90; 96.348; 90 | 1714.2 | Feng, Tao; Li, Li-Li; Li, Ya-Juan; Dong, Wen-Kui A half-salamo-based pyridine-containing ligand and its novel Ni^II^ complexes including different auxiliary ligands: syntheses, structures, fluorescence properties, DFT calculations and Hirshfeld surface analysis Acta Crystallographica Section B, 2021, 77, 168-181 |
| 2108770 | CIF HKL Paper | C18 H16 N6 Ni O4 | P 1 21/n 1 | 9.5255; 17.0181; 11.2611 90; 93.25; 90 | 1822.6 | Feng, Tao; Li, Li-Li; Li, Ya-Juan; Dong, Wen-Kui A half-salamo-based pyridine-containing ligand and its novel Ni^II^ complexes including different auxiliary ligands: syntheses, structures, fluorescence properties, DFT calculations and Hirshfeld surface analysis Acta Crystallographica Section B, 2021, 77, 168-181 |
| 2108771 | CIF HKL | Cu2 Ge Se3 | C 1 c 1 | 6.7703; 11.8624; 6.7705 90; 108.512; 90 | 515.62 | Dugarte-Dugarte, Analio; Ramírez Pineda, Nahum; Nieves, Luis; Henao, José Antonio; Díaz de Delgado, Graciela; Delgado, José Miguel The crystal structure of Cu~2~GeSe~3~ and the structure-types of the I~2~-IV-VI~3~ family of semiconducting compounds Acta Crystallographica Section B, 2021, 77, 158-167 |
| 2108772 | CIF HKL Paper | C5 H12 O5 | P 21 21 21 | 8.2993; 8.9697; 8.9693 90; 90; 90 | 667.69 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108773 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.2694; 8.9403; 8.8438 90; 90; 90 | 653.83 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108774 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.2305; 8.8992; 8.7624 90; 90; 90 | 641.8 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108775 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.2213; 8.883; 8.7242 90; 90; 90 | 637.13 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108776 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.204; 8.854; 8.6809 90; 90; 90 | 630.6 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108777 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.154; 8.7964; 8.561 90; 90; 90 | 614.04 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108778 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.105; 8.752; 8.462 90; 90; 90 | 600.3 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108779 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.0845; 8.67; 8.3725 90; 90; 90 | 586.9 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108780 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.0696; 8.65; 8.309 90; 90; 90 | 580 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108781 | CIF HKL | C5 H12 O5 | P 21 21 21 | 8.0108; 8.627; 8.263 90; 90; 90 | 571 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108782 | CIF HKL | C5 H12 O5 | P 21 21 21 | 7.9846; 8.6043; 8.179 90; 90; 90 | 561.9 | Safari, Fatemeh; Katrusiak, Andrzej Structure‒property relationships of molecular shape and orientation with compression and expansion of xylitol Acta Crystallographica Section B, 2021, 77 |
| 2108783 | CIF HKL Paper | C14 H16 N2 O8 Zn | P -1 | 7.2924; 7.445; 8.0936 97.966; 103.385; 115.659 | 370.76 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
| 2108784 | CIF HKL Paper | C16 H18 N2 O7 Zn | P -1 | 8.2959; 10.1989; 10.3466 70.187; 82.585; 79.659 | 808.01 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
| 2108785 | CIF HKL Paper | C16 H22 N2 O9 Zn | C 1 2/c 1 | 10.8962; 10.3334; 16.6916 90; 108.435; 90 | 1782.94 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
| 2108786 | CIF HKL Paper | C28 H36 N4 O18 Zn2 | P -1 | 7.9237; 8.574; 12.3954 84.248; 74.706; 85.908 | 807.32 | May, Nóra Veronika; Nys, Kevin; Ching, H. Y. Vincent; Bereczki, Laura; Holczbauer, Tamás; Di Marco, Valerio B.; Bombicz, Petra Crystal structures of zinc(II) complexes with β-hydroxypyridinecarboxylate ligands: examples of structure-directing effects used in inorganic crystal engineering Acta Crystallographica Section B, 2021, 77 |
| 2108787 | CIF HKL Paper | C72 H52 Fe2 N22 O2 | P 1 21/c 1 | 18.1614; 22.1885; 17.1716 90; 110.894; 90 | 6464.7 | Cvrtila, Ivica; Stilinović, Vladimir Polymorphs of phenazine hexacyanoferrate(II) hydrate: supramolecular isomerism in a 2D hydrogen-bonded network Acta Crystallographica Section B, 2021, 77 |
| 2108788 | CIF HKL Paper | C72 H52 Fe2 N22 O2 | P -1 | 14.2252; 16.1364; 16.2813 89.859; 67.664; 68.977 | 3187.7 | Cvrtila, Ivica; Stilinović, Vladimir Polymorphs of phenazine hexacyanoferrate(II) hydrate: supramolecular isomerism in a 2D hydrogen-bonded network Acta Crystallographica Section B, 2021, 77 |
| 2108789 | CIF HKL | Al3 Na6 O20 P5 | C 1 2/c 1 | 18.631; 37.41; 9.272 90; 90.063; 90 | 6462 | Yakubovich, Olga V.; Kiriukhina, Galina V.; Volkov, Anatoliy S.; Dimitrova, Olga V.; Borovikova, Elena Yu. Novel aluminophosphate Na~6~[Al~3~P~5~O~20~] with the original microporous crystal structure established in the study of a pseudomerohedric microtwin Acta Crystallographica Section B, 2021, 77 |
| 2108790 | CIF HKL | C3 H17 Al N2 O14 S2 | P 1 2/a 1 | 12.0026; 6.7859; 9.1005 90; 88.835; 90 | 741.07 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108791 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.8748; 6.8748; 9.155 90; 90; 120 | 374.72 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108792 | CIF HKL | C3 H17 Al N2 O14 S2 | P -3 m 1 | 6.868; 6.868; 9.1617 90; 90; 120 | 374.25 | Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108793 | CIF HKL | C16 H19 N3 O2 | P 21 21 21 | 7.7498; 11.794; 17.2849 90; 90; 90 | 1579.86 | Meenatchi, Venkatasamy; Subramanian Siva; Meenakshisundaram, SP; Cheng, Liang Synthesis, crystal growth, characterization and DFT investigation of a nonlinear optically active cuminaldehyde derivative hydrazone Acta Crystallographica Section B, 2021, 77 |
| 2108794 | CIF HKL Paper | C12 H14 Cu N5 O3 S | P 21 21 21 | 7.905; 12.723; 14.678 90; 90; 90 | 1476.2 | Kowalska, Dorota A.; Kinzhybalo, Vasyl; Slyvka, Yuriy I.; Wołcyrz, Marek Crystal structure and enantiomeric layer disorder of a copper(I) nitrate π-coordination compound Acta Crystallographica Section B, 2021, 77 |
| 2108795 | CIF HKL | Ba0.08 Ca0.16 Fe0.38 K0.36 Mg0.1 Mn0.18 Na2.77 O18 Si4 Sr1.45 Ti2.52 | C 1 2/m 1 | 19.405; 7.0885; 5.3988 90; 96.739; 90 | 737.49 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
| 2108796 | CIF HKL | Ba0.87 Ca0.17 Fe0.36 K0.45 Mg0.08 Mn0.24 Na2.46 O18 Si4 Sr0.51 Ti2.86 | C 1 2/m 1 | 19.769; 7.1076; 5.4065 90; 96.731; 90 | 754.43 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
| 2108797 | CIF HKL | Ba0 Ca0.15 Fe0.13 K0.09 Mg0.05 Mn0.35 Na2.8 O18 Si4 Sr1.5 Ti2.82 | C 1 2/m 1 | 19.2231; 7.0832; 5.3907 90; 96.859; 90 | 728.75 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
| 2108798 | CIF HKL | Ba1.15 Ca0.17 Fe0.53 K0.41 Mg0.12 Mn0.12 Na2.7 O18 Si4 Sr0.27 Ti2.53 | C 1 2/m 1 | 19.8574; 7.1034; 5.4063 90; 96.611; 90 | 757.52 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
| 2108799 | CIF HKL | Ba0.05 Ca0.09 Fe0.46 K0.1 Mg0.17 Mn0.17 Na3.1 O18 Si4 Sr1.4 Ti2.43 | C 1 2/m 1 | 19.2616; 7.0663; 5.3735 90; 96.698; 90 | 726.39 | Aksenov, Sergey M.; Ryanskaya, Anastasia D.; Shchapova, Yuliya V.; Chukanov, Nikita V.; Vladykin, Nikolay V.; Votyakov, Sergey L.; Rastsvetaeva, Ramiza K. Crystal chemistry of lamprophyllite-group minerals from the Murun alkaline complex (Russia) and pegmatites of Rocky Boy and Gordon Butte (USA): single crystal X-ray diffraction and Raman spectroscopy study Acta Crystallographica Section B, 2021, 77 |
| 2108800 | CIF HKL Paper | C15 H10 F I O | P 1 21/c 1 | 22.9802; 4.7448; 12.2026 90; 96.534; 90 | 1321.89 | Hamilton, Victoria; Harris, Connah; Hall, Charlie L.; Potticary, Jason; Cremeens, Matthew E.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Pridmore, Natalie E.; Sparkes, Hazel A.; Hall, Simon R. Structural effects of halogen bonding in iodochalcones Acta Crystallographica Section B, 2021, 77 |
| 2108801 | CIF HKL | C15 H10 F I O | P -1 | 6.12; 10.7976; 20.3875 103.101; 95.16; 98.186 | 1288.32 | Hamilton, Victoria; Harris, Connah; Hall, Charlie L.; Potticary, Jason; Cremeens, Matthew E.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Pridmore, Natalie E.; Sparkes, Hazel A.; Hall, Simon R. Structural effects of halogen bonding in iodochalcones Acta Crystallographica Section B, 2021, 77 |
| 2108802 | CIF HKL | C15 H10 I N O3 | P 1 21/c 1 | 17.9016; 5.8824; 25.4871 90; 94.427; 90 | 2675.9 | Hamilton, Victoria; Harris, Connah; Hall, Charlie L.; Potticary, Jason; Cremeens, Matthew E.; D'Ambruoso, Gemma D.; Matsumoto, Masaomi; Warren, Stephen D.; Pridmore, Natalie E.; Sparkes, Hazel A.; Hall, Simon R. Structural effects of halogen bonding in iodochalcones Acta Crystallographica Section B, 2021, 77 |
| 2108803 | CIF | As0.201 H10 O21 P0.799 Pb2 U3 | P 1 21/m 1 | 7.0258; 17.1769; 8.1463 90; 108.886; 90 | 930.18 | Plášil, Jakub; Petříček, Václav; Škácha, Pavel Crystal structure of the uranyl arsenate mineral hügelite, Pb~2~(UO~2~)~3~O~2~(AsO~4~)~2~(H~2~O)~5~, revisited: a correct unit cell, twinning and hydrogen bonding Acta Crystallographica Section B, 2021, 77 |
| 2108804 | CIF | As0.195 O21 P0.805 Pb2 U3 | P 1 21/m 1 | 7.0189; 17.137; 8.131 90; 108.9; 90 | 925.29 | Plášil, Jakub; Petříček, Václav; Škácha, Pavel Crystal structure of the uranyl arsenate mineral hügelite, Pb~2~(UO~2~)~3~O~2~(AsO~4~)~2~(H~2~O)~5~, revisited: a correct unit cell, twinning and hydrogen bonding Acta Crystallographica Section B, 2021, 77 |
| 2108805 | CIF HKL Paper | C31 H39 N O3 | P 21 21 21 | 6.2484; 13.7976; 32.4874 90; 90; 90 | 2800.8 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108806 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.2711; 13.7242; 32.5405 90; 90; 90 | 2800.6 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108807 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.2975; 13.6726; 32.5998 90; 90; 90 | 2806.9 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108808 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.3387; 13.5668; 32.6429 90; 90; 90 | 2807.2 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108809 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.3595; 13.5442; 32.6718 90; 90; 90 | 2814.2 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108810 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.3663; 13.5168; 32.6694 90; 90; 90 | 2811.3 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108811 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.3696; 13.4941; 32.6553 90; 90; 90 | 2806.8 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108812 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.3861; 13.4799; 32.6933 90; 90; 90 | 2814.4 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108813 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.392; 13.4462; 32.676 90; 90; 90 | 2808.4 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108814 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.401; 13.422; 32.51 90; 90; 90 | 2793.1 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108815 | CIF HKL Paper | C31 H39 N O3 | P 21 21 21 | 6.1975; 13.744; 32.378 90; 90; 90 | 2757.9 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108816 | CIF HKL Paper | C31 H39 N O3 | P 21 21 21 | 5.9706; 13.368; 31.832 90; 90; 90 | 2540.7 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108817 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9793; 13.334; 31.884 90; 90; 90 | 2542 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108818 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9907; 13.301; 31.928 90; 90; 90 | 2544.1 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108819 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 6.2884; 13.7572; 32.703 90; 90; 90 | 2829.2 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108820 | CIF HKL Paper | C31 H39 N O3 | P 21 21 21 | 5.9414; 13.381; 31.662 90; 90; 90 | 2517.2 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108821 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9654; 13.321; 31.75 90; 90; 90 | 2523 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108822 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9717; 13.299; 31.81 90; 90; 90 | 2526 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108823 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9814; 13.288; 31.81 90; 90; 90 | 2528 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108824 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.985; 13.301; 31.82 90; 90; 90 | 2533 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108825 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9831; 13.294; 31.84 90; 90; 90 | 2533 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108826 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.9808; 13.293; 31.84 90; 90; 90 | 2531 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108827 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.987; 13.257; 31.84 90; 90; 90 | 2527 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108828 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.997; 13.267; 31.79 90; 90; 90 | 2529 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108829 | CIF HKL | C31 H39 N O3 | P 21 21 21 | 5.956; 13.3207; 31.89 90; 90; 90 | 2530 | Konieczny, Krzysztof A.; Bakowicz, Julia; Paliwoda, Damian; Warren, Mark R.; Ciesielski, Arkadiusz; Cyrański, Michał K.; Turowska-Tyrk, Ilona Structural reasons for the formation of multicomponent products and the influence of high pressure Acta Crystallographica Section B, 2021, 77 |
| 2108830 | CIF HKL | C12 H13 N3 O | P 1 21/n 1 | 9.6282; 9.5416; 11.6064 90; 99.863; 90 | 1050.5 | Tojiboev, Akmaljon G.; Elmuradov, Burkhon Zh.; Mouhib, Halima; Turgunov, Kambarali K.; Abdurazakov, Askar Sh.; Makhmadiyarova, Charos E.; Tashkhodjaev, Bakhodir; Mirzaev, Sirojiddin Z. Structural insight from intermolecular interactions and energy framework analyses of 2-substituted 6,7,8,9-tetrahydro-11<i>H</i>-pyrido[2,1-b]quinazolin-11-ones Acta Crystallographica Section B, 2021, 77 |
| 2108831 | CIF HKL | C12 H11 N3 O3 | P 1 21/n 1 | 13.0177; 5.6433; 15.4366 90; 105.949; 90 | 1090.4 | Tojiboev, Akmaljon G.; Elmuradov, Burkhon Zh.; Mouhib, Halima; Turgunov, Kambarali K.; Abdurazakov, Askar Sh.; Makhmadiyarova, Charos E.; Tashkhodjaev, Bakhodir; Mirzaev, Sirojiddin Z. Structural insight from intermolecular interactions and energy framework analyses of 2-substituted 6,7,8,9-tetrahydro-11<i>H</i>-pyrido[2,1-b]quinazolin-11-ones Acta Crystallographica Section B, 2021, 77 |
| 2108832 | CIF HKL | C19 H17 N3 O2 | P 1 21/n 1 | 10.6548; 12.6232; 22.9326 90; 91.457; 90 | 3083.38 | Tojiboev, Akmaljon G.; Elmuradov, Burkhon Zh.; Mouhib, Halima; Turgunov, Kambarali K.; Abdurazakov, Askar Sh.; Makhmadiyarova, Charos E.; Tashkhodjaev, Bakhodir; Mirzaev, Sirojiddin Z. Structural insight from intermolecular interactions and energy framework analyses of 2-substituted 6,7,8,9-tetrahydro-11<i>H</i>-pyrido[2,1-b]quinazolin-11-ones Acta Crystallographica Section B, 2021, 77 |
| 2108833 | CIF HKL | C12 H28 Br2 Ca O12 | P 1 21 1 | 7.5022; 14.2259; 10.4517 90; 109.931; 90 | 1048.65 | Marabello, Domenica; Antoniotti, Paola; Benzi, Paola; Beccari, Fabio; Canepa, Carlo; Cariati, Elena; Cioci, Alma; Lo Presti, Leonardo Crystal structure or chemical composition of salt‒sugar-based metal‒organic frameworks: what are the nonlinear optical properties due to? Acta Crystallographica Section B, 2021, 77 |
| 2108834 | CIF HKL | C12 H28 Ca I2 O12 | P 1 21 1 | 7.6384; 14.4621; 10.749 90; 109.233; 90 | 1121.14 | Marabello, Domenica; Antoniotti, Paola; Benzi, Paola; Beccari, Fabio; Canepa, Carlo; Cariati, Elena; Cioci, Alma; Lo Presti, Leonardo Crystal structure or chemical composition of salt‒sugar-based metal‒organic frameworks: what are the nonlinear optical properties due to? Acta Crystallographica Section B, 2021, 77 |
| 2108835 | CIF HKL | C12 H11 I2 N S | P 1 21/c 1 | 12.1709; 14.5397; 8.2078 90; 105.485; 90 | 1399.74 | Yushina, Irina; Krylov, Alexander; Leonidov, Ivan I.; Batalov, Vladimir; Chen, Yu-Sheng; Wang, Suyin Grass; Stash, Adam; Bartashevich, Ekaterina The influence of chalcogen atom on conformation and phase transition in chalcogenazinoquinolinium monoiodides Acta Crystallographica Section B, 2021, 77 |
| 2108836 | CIF HKL | C12 H11 I2 N S | P -1 | 8.1178; 12.0928; 14.4689 88.1883; 89.472; 73.9234 | 1364.14 | Yushina, Irina; Krylov, Alexander; Leonidov, Ivan I.; Batalov, Vladimir; Chen, Yu-Sheng; Wang, Suyin Grass; Stash, Adam; Bartashevich, Ekaterina The influence of chalcogen atom on conformation and phase transition in chalcogenazinoquinolinium monoiodides Acta Crystallographica Section B, 2021, 77 |
| 2108837 | CIF HKL | C12 H10 Cl I2 N O | C 1 2/c 1 | 13.7324; 24.4482; 8.2375 90; 96.1485; 90 | 2749.69 | Yushina, Irina; Krylov, Alexander; Leonidov, Ivan I.; Batalov, Vladimir; Chen, Yu-Sheng; Wang, Suyin Grass; Stash, Adam; Bartashevich, Ekaterina The influence of chalcogen atom on conformation and phase transition in chalcogenazinoquinolinium monoiodides Acta Crystallographica Section B, 2021, 77 |
| 2108838 | CIF HKL | Al0.68 Ca1.99 F0.33 H1.61 K0.2 Mg5.09 O23.67 Si7.32 | C 1 2/m 1 | 9.8348; 18.0035; 5.2825 90; 104.996; 90 | 903.47 | Ballirano, Paolo; Celata, Beatrice; Pacella, Alessandro; Bosi, Ferdinando Recommended X-ray single-crystal structure refinement and Rietveld refinement procedure for tremolite Acta Crystallographica Section B, 2021, 77 |
| 2108839 | CIF HKL | Al0.68 Ca1.98 F0.34 H1.66 K0.265 Mg5.045 O23.66 Si7.32 | C 1 2/m 1 | 9.84053; 18.0234; 5.28475 90; 104.956; 90 | 905.55 | Ballirano, Paolo; Celata, Beatrice; Pacella, Alessandro; Bosi, Ferdinando Recommended X-ray single-crystal structure refinement and Rietveld refinement procedure for tremolite Acta Crystallographica Section B, 2021, 77 |
| 2108840 | CIF HKL | C8 H12 Br5 Cr N4 | C 1 2/m 1 | 14.7; 10.319; 6.308 90; 103.685; 90 | 929.7 | Dissanayaka Mudiyanselage, Ranuri S.; Kong, Tai; Xie, Weiwei Crystal growth and physical properties of an antiferromagnetic molecule: <i>trans</i>-dibromidotetrakis(acetonitrile)chromium(III) tribromide, [CrBr~2~(NCCH~3~)~4~](Br~3~) Acta Crystallographica Section B, 2021, 77 |
| 2108841 | CIF HKL Paper | H8 Mg O8 Te | I 4/m m m (a+b,-a+b,c) | 5.3282; 5.3282; 10.3363 90; 90; 90 | 293.445 | Stöger, Berthold; Krüger, Hannes; Weil, Matthias Mg(H~2~O)~2~[TeO~2~(OH)~4~]: a polytypic structure with a two-mode disordered stacking arrangement Acta Crystallographica Section B, 2021, 77 |
| 2108842 | CIF HKL | H8 Mg O8 Te | I 41/a m d :1 | 5.3268; 5.3268; 20.6747 90; 90; 90 | 586.64 | Stöger, Berthold; Krüger, Hannes; Weil, Matthias Mg(H~2~O)~2~[TeO~2~(OH)~4~]: a polytypic structure with a two-mode disordered stacking arrangement Acta Crystallographica Section B, 2021, 77 |
| 2108843 | CIF HKL | H8 Mg O8 Te | I 41/a :1 | 5.3282; 5.3282; 20.6725 90; 90; 90 | 586.886 | Stöger, Berthold; Krüger, Hannes; Weil, Matthias Mg(H~2~O)~2~[TeO~2~(OH)~4~]: a polytypic structure with a two-mode disordered stacking arrangement Acta Crystallographica Section B, 2021, 77 |
| 2108844 | CIF HKL | H8 Mg O8 Te | I -4 2 d | 5.3282; 5.3282; 20.6725 90; 90; 90 | 586.886 | Stöger, Berthold; Krüger, Hannes; Weil, Matthias Mg(H~2~O)~2~[TeO~2~(OH)~4~]: a polytypic structure with a two-mode disordered stacking arrangement Acta Crystallographica Section B, 2021, 77 |
| 2108845 | CIF HKL | Cd109.89 Mg35.29 Y24 | I m -3 | 15.4577; 15.4577; 15.4577 90; 90; 90 | 3693.47 | Yamada, Tsunetomo; Fujita, Nobuhisa; Labib, Farid 2/1 and 1/1 cubic approximants in the ternary <i>R</i>-Cd-Mg (<i>R</i> = Y, Er) systems Acta Crystallographica Section B, 2021, 77 |
| 2108846 | CIF HKL | Cd432.91 Mg177.41 Y90.4 | P a -3 | 25.0654; 25.0654; 25.0654 90; 90; 90 | 15748 | Yamada, Tsunetomo; Fujita, Nobuhisa; Labib, Farid 2/1 and 1/1 cubic approximants in the ternary <i>R</i>-Cd-Mg (<i>R</i> = Y, Er) systems Acta Crystallographica Section B, 2021, 77 |
| 2108847 | CIF HKL Paper | C6 H3 Br3 | P 1 21/c 1 | 12.9832; 8.3806; 15.5159 90; 113.276; 90 | 1550.8 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108848 | CIF HKL Paper | C6 H3 Br3 | P 1 21/c 1 | 12.8999; 8.3264; 15.4925 90; 113.204; 90 | 1529.44 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108849 | CIF HKL Paper | C6 H3 Br3 | P 1 21/c 1 | 12.7973; 8.2623; 15.4666 90; 113.102; 90 | 1504.22 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108850 | CIF HKL Paper | C6 H3 Br3 | F d d 2 | 29.408; 79.439; 3.9865 90; 90; 90 | 9313 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108851 | CIF HKL Paper | C6 H3 Br3 | F d d 2 | 29.383; 79.163; 3.9713 90; 90; 90 | 9237.4 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108852 | CIF HKL Paper | C6 H3 Br3 | F d d 2 | 29.313; 78.645; 3.932 90; 90; 90 | 9064.5 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108853 | CIF HKL Paper | C6 H3 Br3 | P 21 21 21 | 4.06406; 13.5231; 14.1996 90; 90; 90 | 780.39 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108854 | CIF HKL Paper | C6 H3 Br3 | P 21 21 21 | 4.03673; 13.4739; 14.1499 90; 90; 90 | 769.62 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108855 | CIF HKL Paper | C6 H3 Br3 | P 21 21 21 | 4.00341; 13.4119; 14.0916 90; 90; 90 | 756.62 | Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej Properties and interactions ‒ melting point of tribromobenzene isomers Acta Crystallographica Section B, 2021, 77 |
| 2108856 | CIF HKL | C32 Cl16 Cu N8 | C 1 2/m 1 | 17.5447; 25.9863; 3.76308 90; 95.336; 90 | 1708.2 | Gorelik, Tatiana E.; Habermehl, Stefan; Shubin, Aleksandr A.; Gruene, Tim; Yoshida, Kaname; Oleynikov, Peter; Kaiser, Ute; Schmidt, Martin U. Crystal structure of copper perchlorophthalocyanine analysed by 3D electron diffraction Acta Crystallographica Section B, 2021, 77 |
| 2108857 | CIF HKL Paper | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.522; 3.82815; 28.639 90; 129.573; 90 | 3086.4 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108858 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.534; 3.84179; 28.656 90; 129.598; 90 | 3099.1 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108859 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.553; 3.85466; 28.687 90; 129.646; 90 | 3112.3 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108860 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.575; 3.86969; 28.723 90; 129.689; 90 | 3128.3 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108861 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.591; 3.88466; 28.759 90; 129.719; 90 | 3144.4 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108862 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.529; 11.6677; 11.1762 90; 101.608; 90 | 1344.91 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108863 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.5297; 11.67487; 11.1843 90; 101.584; 90 | 1346.91 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108864 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.5318; 11.68404; 11.1931 90; 101.563; 90 | 1349.4 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108865 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.534; 11.69648; 11.2042 90; 101.545; 90 | 1352.55 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108866 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.5373; 11.70992; 11.2176 90; 101.523; 90 | 1356.25 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108867 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.5404; 11.7241; 11.2296 90; 101.504; 90 | 1359.84 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108868 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.544; 11.7396; 11.2426 90; 101.476; 90 | 1363.81 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108869 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.5488; 11.7577; 11.2563 90; 101.456; 90 | 1368.3 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108870 | CIF HKL | C5 H17 N5 Na2 O8 | P 1 21/c 1 | 10.553; 11.7759; 11.2683 90; 101.41; 90 | 1372.65 | Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V. A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O Acta Crystallographica Section B, 2021, 77 |
| 2108871 | CIF HKL | C12 H42 Bi2 Cl12 N6 | C 1 2/c 1 | 27.8842; 10.19431; 12.45639 90; 102.911; 90 | 3451.34 | Bujak, Maciej Understanding distortions of inorganic substructures in chloridobismuthates(III) Acta Crystallographica Section B, 2021, 77 |
| 2108872 | CIF HKL | C12 H42 Bi2 Cl12 N6 | C 1 2/c 1 | 27.5447; 10.14187; 12.38379 90; 102.906; 90 | 3372.08 | Bujak, Maciej Understanding distortions of inorganic substructures in chloridobismuthates(III) Acta Crystallographica Section B, 2021, 77 |
| 2108873 | CIF HKL | C4 H14 Bi Cl5 N2 | P 21 21 21 | 7.60312; 12.50404; 13.63023 90; 90; 90 | 1295.82 | Bujak, Maciej Understanding distortions of inorganic substructures in chloridobismuthates(III) Acta Crystallographica Section B, 2021, 77 |
| 2108874 | CIF HKL | C15 H42 Bi2 Cl9 N9 | P 1 21/n 1 | 10.57031; 29.2063; 12.04367 90; 106.634; 90 | 3562.52 | Bujak, Maciej Understanding distortions of inorganic substructures in chloridobismuthates(III) Acta Crystallographica Section B, 2021, 77 |
| 2108875 | CIF HKL | C5 H14 Bi Cl4 N3 | P -1 | 7.7179; 10.566; 18.0362 95.585; 91.008; 110.965 | 1364.74 | Bujak, Maciej Understanding distortions of inorganic substructures in chloridobismuthates(III) Acta Crystallographica Section B, 2021, 77 |
| 2108876 | CIF HKL Paper | C6 H9 N3 O2 | P 1 21 1 | 5.1651; 7.2324; 9.4957 90; 97.065; 90 | 352.03 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108877 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1656; 7.2761; 9.4978 90; 97.316; 90 | 354.07 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108878 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1854; 7.3998; 9.4976 90; 98.182; 90 | 360.72 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108879 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.1498; 7.1902; 18.8503 90; 90; 90 | 697.99 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108880 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.1521; 7.2228; 18.844 90; 90; 90 | 701.23 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108881 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.169; 7.343; 18.8317 90; 90; 90 | 714.78 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108882 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1651; 7.2324; 9.4957 90; 97.065; 90 | 352.03 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108883 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1656; 7.2761; 9.4978 90; 97.316; 90 | 354.07 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108884 | CIF HKL | C6 H9 N3 O2 | P 1 21 1 | 5.1854; 7.3998; 9.4976 90; 98.182; 90 | 360.72 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108885 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.1498; 7.1902; 18.8503 90; 90; 90 | 697.99 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108886 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.1521; 7.2228; 18.844 90; 90; 90 | 701.23 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108887 | CIF HKL | C6 H9 N3 O2 | P 21 21 21 | 5.169; 7.343; 18.8317 90; 90; 90 | 714.78 | Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K Acta Crystallographica Section B, 2021, 77 |
| 2108888 | CIF HKL Paper | C58 H62 Cl2 Cu4 N12 O34 | P 1 21/n 1 | 15.2568; 14.5155; 15.455 90; 92.086; 90 | 3420.4 | Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand Acta Crystallographica Section B, 2021, 77 |
| 2108889 | CIF HKL | C62 H70 Cu4 N14 O32 | P 1 21/n 1 | 15.1553; 15.2135; 15.1959 90; 94.292; 90 | 3493.8 | Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand Acta Crystallographica Section B, 2021, 77 |
| 2108890 | CIF HKL | C30 H31 Br2 Cl3 Cu2 N6 O12 | C 1 c 1 | 14.333; 17.1049; 16.3502 90; 101.859; 90 | 3922.93 | Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand Acta Crystallographica Section B, 2021, 77 |
| 2108891 | CIF | C6 H12 N3 O3 | A m a 2 | 12.1054; 13.5537; 5.20741 90; 90; 90 | 854.4 | Gallo, Gianpiero; Terban, Maxwell W.; Moudrakovski, Igor; Huber, Tatjana; Etter, Martin; Ernst, Martin; Hinrichsen, Bernd; Dinnebier, Robert E. A previously unknown cyclic alkanolamine and molecular ranking using the pair distribution function Acta Crystallographica Section B, 2021, 77, 986-995 |
| 2108892 | CIF | C7 H8 Cl N3 O4 S2 | P 1 21 1 | 7.3288; 8.5032; 9.9467 90; 111.29; 90 | 577.558 | Wojnarska, Joanna; Gryl, Marlena; Seidler, Tomasz; Stadnicka, Katarzyna Marta Investigation of polar crystalline materials containing hydrochlorothiazide: electron density distribution and optical properties Acta Crystallographica Section B, 2021, 77, 965-973 |
| 2108893 | CIF HKL | C12 H11 N O5 | P c a 21 | 13.6648; 11.9321; 12.9678 90; 90; 90 | 2114.4 | Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis Acta Crystallographica Section B, 2021, 77, 1035-1047 |
| 2108894 | CIF | C12 H11 N O5 | P c a 21 | 13.6648; 11.9321; 12.9678 90; 90; 90 | 2114.4 | Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis Acta Crystallographica Section B, 2021, 77, 1035-1047 |
| 2108895 | CIF | C12 H11 N O5 | P c a 21 | 13.6648; 11.9321; 12.9678 90; 90; 90 | 2114.4 | Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis Acta Crystallographica Section B, 2021, 77, 1035-1047 |
| 2108896 | CIF HKL | C12 H11 N O5 | P c a 21 | 13.6648; 11.9321; 12.9678 90; 90; 90 | 2114.4 | Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis Acta Crystallographica Section B, 2021, 77, 1035-1047 |
| 2108897 | CIF HKL | C21 H29 N O2 | P 21 21 21 | 5.913; 15.305; 22.257 90; 90; 90 | 2014.2 | Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments Acta Crystallographica Section B, 2021, 77, 892-905 |
| 2108898 | CIF HKL | C20 H29 N O2 Si | P 21 21 21 | 6.816; 12.721; 23.613 90; 90; 90 | 2047.4 | Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments Acta Crystallographica Section B, 2021, 77, 892-905 |
| 2108899 | CIF HKL | C19 H32 N4 O4 | P 21 21 21 | 9.3033; 14.8134; 29.664 90; 90; 90 | 4088.1 | Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments Acta Crystallographica Section B, 2021, 77, 892-905 |
| 2108900 | CIF HKL Paper | C4 H15 O15 Rh | C 1 2/c 1 | 16.2131; 13.0362; 6.3015 90; 99.572; 90 | 1313.32 | Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid Acta Crystallographica Section B, 2021, 77, 1048-1054 |
| 2108901 | CIF HKL | C4 H11 Na2 O14 Rh | P -1 | 5.55; 6.44; 8.59 94.2; 99.4; 98.1 | 298.42 | Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid Acta Crystallographica Section B, 2021, 77, 1048-1054 |
| 2108902 | CIF HKL | C4 H8 Na O12 Rh | P -1 | 5.2554; 6.4584; 8.2102 97.796; 92.099; 112.113 | 254.612 | Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid Acta Crystallographica Section B, 2021, 77, 1048-1054 |
| 2108903 | CIF HKL | C4 H8 Na O12 Rh | P -1 | 6.2055; 7.8091; 10.7762 95.557; 98.352; 98.065 | 507.88 | Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid Acta Crystallographica Section B, 2021, 77, 1048-1054 |
| 2108904 | CIF HKL Paper | C54 H52 Cl4 Ni O2 P2 S6 | P 1 21/n 1 | 13.8788; 11.5765; 16.4387 90; 90.651; 90 | 2641 | Adamko Koziskova, Julia; Chen, Yu-Sheng; Grass, Su-Yin; Chuang, Yu-Chun; Hsu, I-Jui; Wang, Yu; Lutz, Martin; Volkov, Anatoliy; Herich, Peter; Vénosová, Barbora; Jelemenská, Ingrid; Bučinský, Lukáš; Breza, Martin; Kožíšek, Jozef Electronic structure of (MePh~3~P)~2~[Ni^II^(bdtCl~2~)~2~]·2(CH~3~)~2~SO and (MePh~3~P)[Ni^III^(bdtCl~2~)~2~] (bdtCl~2~ = 3,6-dichlorobenzene-1,2-dithiolate) Acta Crystallographica Section B, 2021, 77, 919-929 |
| 2108905 | CIF HKL Paper | C31 H22 Cl4 Ni P S4 | P 1 21/c 1 | 13.3664; 14.4849; 15.9712 90; 93.054; 90 | 3087.81 | Adamko Koziskova, Julia; Chen, Yu-Sheng; Grass, Su-Yin; Chuang, Yu-Chun; Hsu, I-Jui; Wang, Yu; Lutz, Martin; Volkov, Anatoliy; Herich, Peter; Vénosová, Barbora; Jelemenská, Ingrid; Bučinský, Lukáš; Breza, Martin; Kožíšek, Jozef Electronic structure of (MePh~3~P)~2~[Ni^II^(bdtCl~2~)~2~]·2(CH~3~)~2~SO and (MePh~3~P)[Ni^III^(bdtCl~2~)~2~] (bdtCl~2~ = 3,6-dichlorobenzene-1,2-dithiolate) Acta Crystallographica Section B, 2021, 77, 919-929 |
| 2108906 | CIF HKL Paper | C31 H22 Cl4 Ni P S4 | P 1 21/c 1 | 13.3785; 14.4463; 15.9474 90; 93.364; 90 | 3076.84 | Adamko Koziskova, Julia; Chen, Yu-Sheng; Grass, Su-Yin; Chuang, Yu-Chun; Hsu, I-Jui; Wang, Yu; Lutz, Martin; Volkov, Anatoliy; Herich, Peter; Vénosová, Barbora; Jelemenská, Ingrid; Bučinský, Lukáš; Breza, Martin; Kožíšek, Jozef Electronic structure of (MePh~3~P)~2~[Ni^II^(bdtCl~2~)~2~]·2(CH~3~)~2~SO and (MePh~3~P)[Ni^III^(bdtCl~2~)~2~] (bdtCl~2~ = 3,6-dichlorobenzene-1,2-dithiolate) Acta Crystallographica Section B, 2021, 77, 919-929 |
| 2108907 | CIF Paper | C12 H19 N3 O8 S | P 1 21/c 1 | 11.2921; 17.8132; 8.3448 90; 110.575; 90 | 1571.47 | Shteingolts, Sergey A.; Voronina, Julia K.; Saifina, Liliya F.; Shulaeva, Marina M.; Semenov, Vyacheslav E.; Fayzullin, Robert R. On the transfer of theoretical multipole parameters for restoring static electron density and revealing and treating atomic anharmonic motion. Features of chemical bonding in crystals of an isocyanuric acid derivative Acta Crystallographica Section B, 2021, 77, 871-891 |
| 2108908 | CIF HKL Paper | C4 H7 N5 O3 | P 1 21/c 1 | 5.1374; 10.305; 13.935 90; 99.71; 90 | 727.2 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108909 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.1439; 10.2415; 14.008 90; 100.11; 90 | 726.5 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108910 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.1216; 10.2236; 13.952 90; 99.7; 90 | 720.1 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108911 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.0993; 10.252; 13.845 90; 99.11; 90 | 714.7 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108912 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.1064; 10.1978; 13.867 90; 99.36; 90 | 712.5 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108913 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.0897; 10.213; 13.789 90; 98.86; 90 | 708.2 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108914 | CIF | C4 H7 N5 O3 | P 1 21/c 1 | 5.0963; 10.1784; 13.823 90; 99.25; 90 | 707.7 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108915 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.0956; 10.1775; 13.792 90; 99.13; 90 | 706.2 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108916 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.0851; 10.1654; 13.751 90; 98.93; 90 | 702.2 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108917 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.099; 10.193; 13.666 90; 98.65; 90 | 702.2 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108918 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.0608; 10.1526; 13.677 90; 98.54; 90 | 694.9 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108919 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.036; 10.162; 13.54 90; 97.94; 90 | 686.3 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108920 | CIF | C4 H7 N5 O3 | P 1 21/c 1 | 5.024; 10.158; 13.43 90; 97.88; 90 | 679 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108921 | CIF | C4 H7 N5 O3 | P 1 21/c 1 | 5.028; 10.152; 13.36 90; 97.9; 90 | 675 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108922 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 4.984; 10.093; 13.53 90; 99.3; 90 | 672 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108923 | CIF HKL | C4 H7 N5 O3 | P -1 | 5.0927; 10.2465; 13.6617 88.714; 98.962; 92.48 | 703.45 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108924 | CIF HKL | C4 H7 N5 O3 | P 1 21/c 1 | 5.1532; 10.2613; 14.0623 90; 100.401; 90 | 731.38 | Rejnhardt, Piotr; Drozd, Marek; Daszkiewicz, Marek Low-temperature phase transition and high-pressure phase stability of 1<i>H</i>-pyrazole-1-carboxamidine nitrate Acta Crystallographica Section B, 2021, 77, 996-1002 |
| 2108925 | CIF HKL Paper | Cu8 K5.13 Na10.87 O64 S16 | P 1 21/c 1 | 12.5085; 9.3166; 12.7894 90; 107.775; 90 | 1419.29 | Siidra, Oleg I.; Charkin, Dmitry O.; Kovrugin, Vadim M.; Borisov, Artem S. K(Na,K)Na~2~[Cu~2~(SO~4~)~4~]: a new highly porous anhydrous sulfate and evaluation of possible ion migration pathways Acta Crystallographica Section B, 2021, 77, 1003-1011 |
| 2108926 | CIF HKL Paper | C19 H18 N2 O5 S | P 1 21/c 1 | 9.5015; 11.992; 31.506 90; 95.785; 90 | 3571.6 | Shishkina, Svitlana V.; Shaposhnyk, Anna M.; Baumer, Vyacheslav N.; Voloshchuk, Natali I.; Bondarenko, Pavlo S.; Ukrainets, Igor V. 1-Allyl-4-hydroxy-2,2-dioxo-<i>N</i>-(4-methoxyphenyl)-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide: polymorphic transition due to grinding with the loss of the biological activity Acta Crystallographica Section B, 2022, 78 |
| 2108927 | CIF HKL | C19 H18 N2 O5 S | P -1 | 7.2868; 10.6462; 11.5637 87.896; 76.578; 87.155 | 871.2 | Shishkina, Svitlana V.; Shaposhnyk, Anna M.; Baumer, Vyacheslav N.; Voloshchuk, Natali I.; Bondarenko, Pavlo S.; Ukrainets, Igor V. 1-Allyl-4-hydroxy-2,2-dioxo-<i>N</i>-(4-methoxyphenyl)-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide: polymorphic transition due to grinding with the loss of the biological activity Acta Crystallographica Section B, 2022, 78 |
| 2108928 | CIF HKL Paper | C10 H9 N17 O18 | P 1 21/c 1 | 11.7438; 15.8026; 12.5832 90; 100.074; 90 | 2299.22 | Lian, Pengbao; Zhang, Luyao; Su, Hongping; Chen, Jun; Chen, Lizhen; Wang, Jianlong A novel energetic cocrystal composed of CL-20 and 1-methyl-2,4,5-trinitroimidazole with high energy and low sensitivity Acta Crystallographica Section B, 2022, 78 |
| 2108929 | CIF HKL | Cs N O3 | P m -3 m | 4.5226; 4.5226; 4.5226 90; 90; 90 | 92.5 | Fábry, Jan; Kučeráková, Monika; Dušek, Michal; Buixaderas, Elena; Hlinka, Jiří Structure of the high-temperature phase of caesium nitrate – the importance of high-resolution data Acta Crystallographica Section B, 2022, 78 |
| 2108930 | CIF HKL Paper | C18 H16 N O3 P | P 1 21/n 1 | 9.8195; 9.8992; 16.2764 90; 94.985; 90 | 1576.17 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108931 | CIF HKL | C18 H15 Br N O3 P | P -1 | 8.4356; 9.2086; 11.2129 79.719; 86.293; 73.677 | 822.39 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108932 | CIF HKL | C18 H15 Cl N O3 P | P -1 | 8.4547; 9.2155; 11.0953 79.742; 86.939; 72.784 | 812.55 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108933 | CIF HKL | C18 H15 I N O3 P | P -1 | 8.4777; 9.2823; 11.4187 79.545; 85.778; 75.12 | 853.67 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108934 | CIF HKL | C18 H15 Br N O3 P | P -1 | 10.0639; 10.2306; 10.5227 107.907; 95.159; 118.01 | 874.05 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108935 | CIF HKL | C18 H15 Cl N O3 P | P 1 21/n 1 | 9.6702; 18.1551; 10.1914 90; 110.184; 90 | 1679.4 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108936 | CIF HKL | C18 H15 F N O3 P | P c a 21 | 35.0174; 7.3265; 12.927 90; 90; 90 | 3316.5 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108937 | CIF HKL | C18 H15 I N O3 P | P -1 | 10.06; 10.4577; 10.6104 109.098; 95.734; 116.967 | 898.35 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108938 | CIF HKL | C18 H15 Br N O3 P | C 1 2/c 1 | 24.8534; 7.2695; 19.7913 90; 103.346; 90 | 3479.16 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108939 | CIF HKL | C18 H15 Cl N O3 P | P 1 21/c 1 | 10.3815; 9.3201; 17.813 90; 90.725; 90 | 1723.39 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108940 | CIF HKL | C18 H15 F N O3 P | P -1 | 10.1285; 9.148; 17.8798 86.225; 90.171; 91.354 | 1652.6 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108941 | CIF HKL | C18 H15 I N O3 P | C 1 2/c 1 | 25.2005; 7.3428; 19.8275 90; 103.083; 90 | 3573.69 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108942 | CIF HKL | C18 H14 F2 N O3 P | P 1 21/c 1 | 10.1665; 9.3374; 17.5495 90; 94.912; 90 | 1659.83 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108943 | CIF HKL | C18 H14 F2 N O3 P | P -1 | 9.2189; 10.0245; 10.0445 68.276; 84.831; 69.889 | 809.02 | Hasija, Avantika; Som, Shubham; Chopra, Deepak Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates Acta Crystallographica Section B, 2022, 78 |
| 2108944 | CIF HKL Paper | C20 H10 F2 N2 O2 | P 1 21/c 1 | 14.2169; 3.76791; 13.7214 90; 102.298; 90 | 718.16 | Habermehl, Stefan; Schlesinger, Carina; Schmidt, Martin U. Structure determination from unindexed powder data from scratch by a global optimization approach using pattern comparison based on cross-correlation functions Acta Crystallographica Section B, 2022, 78 |
| 2108945 | CIF HKL Paper | C20 H10 Cl2 N2 O2 | P -1 | 3.7718; 6.4792; 15.774 93.744; 92.189; 100.918 | 377.2 | Habermehl, Stefan; Schlesinger, Carina; Schmidt, Martin U. Structure determination from unindexed powder data from scratch by a global optimization approach using pattern comparison based on cross-correlation functions Acta Crystallographica Section B, 2022, 78 |
| 2108946 | CIF HKL Paper | C15 H12 | P 1 21/c 1 | 8.7976; 14.331; 7.986 90; 96.276; 90 | 1000.8 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108947 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.7885; 14.26; 8.0361 90; 96.465; 90 | 1000.7 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108948 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.672; 14.14; 8.197 90; 97.39; 90 | 997 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108949 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.485; 13.72; 8.568 90; 99.15; 90 | 985 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108950 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.444; 13.728; 8.5839 90; 99.365; 90 | 981.8 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108951 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.782; 14.117; 7.9575 90; 96.241; 90 | 980.7 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108952 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.785; 14.1121; 7.9525 90; 96.26; 90 | 980 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108953 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.7518; 14.129; 7.9658 90; 96.24; 90 | 979.17 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108954 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.7; 14.11; 7.995 90; 96.57; 90 | 975 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108955 | CIF HKL | C15 H12 | P 1 21/c 1 | 8.48; 13.582; 8.538 90; 99.2; 90 | 971 | Bakowicz, Julia; Turowska-Tyrk, Ilona The role of free space in photochemical reactions in crystals at high pressure – the case of 9-methylanthracene Acta Crystallographica Section B, 2022, 78 |
| 2108956 | CIF HKL | C32 H36 N2 O24 | P -1 | 7.7242; 9.0042; 13.3769 92.44; 96.223; 112.469 | 851.09 | Pal, Rumpa; Jelsch, Christian; Momma, Koichi; Grabowsky, Simon π-Hole bonding in a new co-crystal hydrate of gallic acid and pyrazine: static and dynamic charge density analysis Acta Crystallographica Section B, 2022, 78 |
| 2108957 | CIF Paper | C36 H39 N3 | R -3 :H | 52.879; 52.879; 5.36308 90; 90; 120 | 12987.1 | Vilche, Anna; Bujaldón, Roger; Alcobé, Xavier; Velasco, Dolores; Puigjaner, Cristina Powder X-ray diffraction as a powerful tool to exploit in organic electronics: shedding light on the first <i>N</i>,<i>N</i>',<i>N</i>''-trialkyldiindolocarbazole Acta Crystallographica Section B, 2022, 78, 253-260 |
| 2108958 | CIF HKL | C24 H14 N4 O2 S | P 1 21/n 1 | 20.6752; 3.7474; 25.1061 90; 111.624; 90 | 1808.28 | Postnikov, Valery A.; Sorokina, Natalia I.; Kulishov, Artem A.; Lyasnikova, Maria S.; Sorokin, Timofei A.; Freidzon, Alexandra Ya.; Stepko, Anastasia S.; Borshchev, Oleg V.; Skorotetsky, Maxim S.; Surin, Nikolay M.; Svidchenko, Evgeniya A.; Ponomarenko, Sergey A. A new linear phenyloxazole–benzothiadiazole luminophore: crystal growth, structure and fluorescence properties Acta Crystallographica Section B, 2022, 78, 261-269 |
| 2108959 | CIF HKL | C24 H14 N4 O2 S | P 1 21/n 1 | 20.7891; 3.8267; 25.145 90; 111.747; 90 | 1858 | Postnikov, Valery A.; Sorokina, Natalia I.; Kulishov, Artem A.; Lyasnikova, Maria S.; Sorokin, Timofei A.; Freidzon, Alexandra Ya.; Stepko, Anastasia S.; Borshchev, Oleg V.; Skorotetsky, Maxim S.; Surin, Nikolay M.; Svidchenko, Evgeniya A.; Ponomarenko, Sergey A. A new linear phenyloxazole–benzothiadiazole luminophore: crystal growth, structure and fluorescence properties Acta Crystallographica Section B, 2022, 78, 261-269 |
| 2108960 | CIF | Al5 Dy0.75 Gd0.75 Ho0.75 O12 Tb0.75 | I a -3 d | 12.08917; 12.08917; 12.08917 90; 90; 90 | 1766.81 | Pianassola, Matheus; Alexander, Marlena; Chakoumakos, Bryan; Koschan, Merry; Melcher, Charles; Zhuravleva, Mariya Effects of composition and growth parameters on phase formation in multicomponent aluminum garnet crystals Acta Crystallographica Section B, 2022, 78 |
| 2108961 | CIF | Al5 Dy0.75 Gd0.75 Lu0.75 O12 Tb0.75 | I a -3 d | 12.0516; 12.0516; 12.0516 90; 90; 90 | 1750.39 | Pianassola, Matheus; Alexander, Marlena; Chakoumakos, Bryan; Koschan, Merry; Melcher, Charles; Zhuravleva, Mariya Effects of composition and growth parameters on phase formation in multicomponent aluminum garnet crystals Acta Crystallographica Section B, 2022, 78 |
| 2108962 | CIF | Al5 Dy0.75 Gd0.75 Lu0.75 O12 Tb0.75 | I a -3 d | 12.0703; 12.0703; 12.0703 90; 90; 90 | 1758.55 | Pianassola, Matheus; Alexander, Marlena; Chakoumakos, Bryan; Koschan, Merry; Melcher, Charles; Zhuravleva, Mariya Effects of composition and growth parameters on phase formation in multicomponent aluminum garnet crystals Acta Crystallographica Section B, 2022, 78 |
| 2108963 | CIF HKL | C33 H52 O4 | P 21 21 21 | 11.8862; 13.1419; 18.8884 90; 90; 90 | 2950.51 | Langer, Dominik; Wicher, Barbara; Tykarska, Ewa Single-crystal-to-single-crystal phase transition of 18β-glycyrrhetinic acid isopropyl ester Acta Crystallographica Section B, 2022, 78 |
| 2108964 | CIF | C33 H52 O4 | P 21 21 21 | 13.1807; 13.2466; 17.2198 90; 90; 90 | 3006.57 | Langer, Dominik; Wicher, Barbara; Tykarska, Ewa Single-crystal-to-single-crystal phase transition of 18β-glycyrrhetinic acid isopropyl ester Acta Crystallographica Section B, 2022, 78 |
| 2108965 | CIF HKL | C32 H50 O4 | P 21 21 21 | 13.02432; 12.99238; 16.69407 90; 90; 90 | 2824.92 | Langer, Dominik; Wicher, Barbara; Tykarska, Ewa Single-crystal-to-single-crystal phase transition of 18β-glycyrrhetinic acid isopropyl ester Acta Crystallographica Section B, 2022, 78 |
| 2108966 | CIF HKL | C36 H57 N O5 | P 21 21 21 | 12.9136; 13.7752; 18.7441 90; 90; 90 | 3334.34 | Langer, Dominik; Wicher, Barbara; Tykarska, Ewa Single-crystal-to-single-crystal phase transition of 18β-glycyrrhetinic acid isopropyl ester Acta Crystallographica Section B, 2022, 78 |
| 2108967 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9129; 6.4872; 11.2465 90; 90.4816; 90 | 504.336 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108968 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9146; 6.4963; 11.252 90; 90.49; 90 | 505.414 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108969 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9165; 6.5072; 11.2575 90; 90.4987; 90 | 506.648 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108970 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9184; 6.5187; 11.2646 90; 90.5108; 90 | 508.002 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108971 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9209; 6.5336; 11.2726 90; 90.5215; 90 | 509.708 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108972 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9254; 6.5582; 11.2866 90; 90.5441; 90 | 512.593 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108973 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9303; 6.5873; 11.3017 90; 90.5672; 90 | 515.92 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108974 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.935; 6.619; 11.3172 90; 90.5886; 90 | 519.463 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108975 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9413; 6.6532; 11.3353 90; 90.608; 90 | 523.46 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108976 | CIF Paper | C2 H4 N4 O4 | P 1 21/n 1 | 6.9484; 6.6942; 11.3547 90; 90.618; 90 | 528.12 | Aree, Thammarat; McMonagle, Charles J.; Michalchuk, Adam A. L.; Chernyshov, Dmitry Low-frequency lattice vibrations from atomic displacement parameters of α-FOX-7, a high energy density material Acta Crystallographica Section B, 2022, 78 |
| 2108977 | CIF HKL | C8.25 H25.5 Br1.5 Fe0.75 N4.5 O0.75 | R -3 m :H | 7.3806; 7.3806; 31.5783 90; 90; 120 | 1489.71 | Chernyshov, Dmitry; Dyadkin, Vadim; Törnroos, Karl Wilhelm Preliminary observations of the interplay of radiation damage with spin crossover Acta Crystallographica Section B, 2022, 78 |
| 2108978 | CIF HKL | C8.25 H25.5 Br1.5 Fe0.75 N4.5 O0.75 | R -3 m :H | 7.3869; 7.3869; 31.2243 90; 90; 120 | 1475.53 | Chernyshov, Dmitry; Dyadkin, Vadim; Törnroos, Karl Wilhelm Preliminary observations of the interplay of radiation damage with spin crossover Acta Crystallographica Section B, 2022, 78 |
| 2108979 | CIF HKL | C8.25 H25.5 Br1.5 Fe0.75 N4.5 O0.75 | R -3 m :H | 7.4091; 7.4091; 31.216 90; 90; 120 | 1484.02 | Chernyshov, Dmitry; Dyadkin, Vadim; Törnroos, Karl Wilhelm Preliminary observations of the interplay of radiation damage with spin crossover Acta Crystallographica Section B, 2022, 78 |
| 2108980 | CIF HKL | C42 H54 F12 I2 P2 | P -1 | 10.321; 15.231; 15.663 82.73; 80.201; 71.847 | 2298.4 | Zheng, Dan Ni; Szell, Patrick M. J.; Khiri, Safaa; Ovens, Jeffrey S.; Bryce, David L. Solid-state multinuclear magnetic resonance and X-ray crystallographic investigation of the phosphorus···iodine halogen bond in a bis(dicyclohexylphenylphosphine)(1,6-diiodoperfluorohexane) cocrystal Acta Crystallographica Section B, 2022, 78 |
| 2108981 | CIF HKL Paper | C6 H24 Co2 N6 O15 | P -3 | 12.3686; 12.3686; 21.1962 90; 90; 120 | 2808.21 | Filatov, Evgeny; Lagunova, Varvara; Kochetygov, Ilia; Plyusnin, Pavel; Kuratieva, Natalia; Kostin, Gennadiy; Korenev, Sergey Synthesis and investigation of the thermal properties of [Co(NH~3~)~6~][Co(C~2~O~4~)~3~]·3H~2~O and [Ir(NH~3~)~6~][Ir(C~2~O~4~)~3~] Acta Crystallographica Section B, 2022, 78 |
| 2108982 | CIF HKL Paper | C6 H18 Ir2 N6 O12 | P -1 | 7.56; 9.7304; 11.9386 84.368; 87.579; 70.534 | 823.99 | Filatov, Evgeny; Lagunova, Varvara; Kochetygov, Ilia; Plyusnin, Pavel; Kuratieva, Natalia; Kostin, Gennadiy; Korenev, Sergey Synthesis and investigation of the thermal properties of [Co(NH~3~)~6~][Co(C~2~O~4~)~3~]·3H~2~O and [Ir(NH~3~)~6~][Ir(C~2~O~4~)~3~] Acta Crystallographica Section B, 2022, 78 |
| 2108983 | CIF HKL Paper | C12 H30 Co Ir2 K3 N6 O30 | R -3 :H | 10.2003; 10.2003; 29.408 90; 90; 120 | 2649.9 | Filatov, Evgeny; Lagunova, Varvara; Kochetygov, Ilia; Plyusnin, Pavel; Kuratieva, Natalia; Kostin, Gennadiy; Korenev, Sergey Synthesis and investigation of the thermal properties of [Co(NH~3~)~6~][Co(C~2~O~4~)~3~]·3H~2~O and [Ir(NH~3~)~6~][Ir(C~2~O~4~)~3~] Acta Crystallographica Section B, 2022, 78 |
| 2108984 | CIF HKL Paper | C68 H67 N4 O18 Zn2 | C 1 2 1 | 12.05; 8.11; 31.47 90; 92.48; 90 | 3073 | Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes Acta Crystallographica Section B, 2022, 78 |
| 2108985 | CIF HKL | C22 H32 Cu N2 O12 | P 1 21 1 | 13.9887; 6.891; 14.3405 90; 109.51; 90 | 1303 | Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes Acta Crystallographica Section B, 2022, 78 |
| 2108986 | CIF HKL | C22 H24 Cu N2 O8 | P 1 21/c 1 | 11.279; 5.5252; 17.45 90; 96.84; 90 | 1079.7 | Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes Acta Crystallographica Section B, 2022, 78 |
| 2108987 | CIF HKL | C34 H34 Cu N2 O9 | P 1 | 7.245; 7.251; 16.014 91.685; 97.664; 112.798 | 765.6 | Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes Acta Crystallographica Section B, 2022, 78 |
| 2108988 | CIF | C22 H32 Cu N4 O9 | P 1 21 1 | 13.9687; 6.8845; 14.3443 90; 109.401; 90 | 1301.13 | Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes Acta Crystallographica Section B, 2022, 78 |
| 2108989 | CIF HKL Paper | B4 Bi0.07 Fe3 O12 Sm0.93 | R 3 2 :H | 9.5638; 9.5638; 7.579 90; 90; 120 | 600.349 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Yapaskurt, Vasily O.; Lyubutina, Marianna V.; Frolov, Kirill V.; Lyubutin, Igor S.; Gudim, Irina A. Crystal structure, absolute configuration and characteristic temperatures of SmFe~3~(BO~3~)~4~ in the temperature range 11–400K Acta Crystallographica Section B, 2022, 78 |
| 2108990 | CIF HKL Paper | B4 Bi0.07 Fe3 O12 Sm0.93 | R 3 2 :H | 9.5635; 9.5635; 7.5823 90; 90; 120 | 600.572 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Yapaskurt, Vasily O.; Lyubutina, Marianna V.; Frolov, Kirill V.; Lyubutin, Igor S.; Gudim, Irina A. Crystal structure, absolute configuration and characteristic temperatures of SmFe~3~(BO~3~)~4~ in the temperature range 11–400K Acta Crystallographica Section B, 2022, 78 |
| 2108991 | CIF HKL Paper | B4 Bi0.07 Fe3 O12 Sm0.93 | R 3 2 :H | 9.5642; 9.5642; 7.5883 90; 90; 120 | 601.136 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Yapaskurt, Vasily O.; Lyubutina, Marianna V.; Frolov, Kirill V.; Lyubutin, Igor S.; Gudim, Irina A. Crystal structure, absolute configuration and characteristic temperatures of SmFe~3~(BO~3~)~4~ in the temperature range 11–400K Acta Crystallographica Section B, 2022, 78 |
| 2108992 | CIF HKL Paper | B4 Bi0.07 Fe3 O12 Sm0.93 | R 3 2 :H | 9.565; 9.565; 7.5972 90; 90; 120 | 601.941 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Yapaskurt, Vasily O.; Lyubutina, Marianna V.; Frolov, Kirill V.; Lyubutin, Igor S.; Gudim, Irina A. Crystal structure, absolute configuration and characteristic temperatures of SmFe~3~(BO~3~)~4~ in the temperature range 11–400K Acta Crystallographica Section B, 2022, 78 |
| 2108993 | CIF HKL Paper | B4 Fe3 O12 Sm | R 3 2 :H | 9.5665; 9.5665; 7.5911 90; 90; 120 | 601.647 | Smirnova, Ekaterina S.; Alekseeva, Olga A.; Dudka, Alexander P.; Sorokin, Timofei A.; Khmelenin, Dmitry N.; Yapaskurt, Vasily O.; Lyubutina, Marianna V.; Frolov, Kirill V.; Lyubutin, Igor S.; Gudim, Irina A. Crystal structure, absolute configuration and characteristic temperatures of SmFe~3~(BO~3~)~4~ in the temperature range 11–400K Acta Crystallographica Section B, 2022, 78 |
| 2108994 | CIF HKL | C32 H50 Cu F2 N6 O17 S | P 1 21/c 1 | 10.4613; 31.2244; 12.2241 90; 104.45; 90 | 3866.66 | Tobón Zapata, Gloria Elena; Martínez Carmona, Dina Marcela; Echeverría, Gustavo Alberto; Piro, Oscar Enrique Molecular structures of two copper complexes with the pharmaceuticals norfloxacin and tinidazole, when powder X-ray diffraction assists multi-domain single-crystal X-ray diffraction Acta Crystallographica Section B, 2022, 78 |
| 2108995 | CIF HKL | C16 H26 Cu N8 O14 S2 | P 1 21/c 1 | 7.3063; 10.8907; 16.4396 90; 90.67; 90 | 1308.02 | Tobón Zapata, Gloria Elena; Martínez Carmona, Dina Marcela; Echeverría, Gustavo Alberto; Piro, Oscar Enrique Molecular structures of two copper complexes with the pharmaceuticals norfloxacin and tinidazole, when powder X-ray diffraction assists multi-domain single-crystal X-ray diffraction Acta Crystallographica Section B, 2022, 78 |
| 2108996 | CIF Paper | C12 H16 N2 O5 | C 1 2/c 1 | 16.0117; 9.6657; 17.4382 90; 101.948; 90 | 2640.3 | Konovalova, Irina S.; Shaposhnyk, Anna M.; Baumer, Vyacheslav N.; Chalyk, Bohdan A.; Shishkina, Svitlana V. Polymorphic transition due to grinding: the case of 3-[1-(<i>tert</i>-butoxycarbonyl)azetidin-3-yl]-1,2-oxazole-4-carboxylic acid Acta Crystallographica Section B, 2022, 78 |
| 2108997 | CIF HKL | C12 H16 N2 O5 | P 1 21/c 1 | 14.3254; 8.7613; 11.4085 90; 112.48; 90 | 1323.07 | Konovalova, Irina S.; Shaposhnyk, Anna M.; Baumer, Vyacheslav N.; Chalyk, Bohdan A.; Shishkina, Svitlana V. Polymorphic transition due to grinding: the case of 3-[1-(<i>tert</i>-butoxycarbonyl)azetidin-3-yl]-1,2-oxazole-4-carboxylic acid Acta Crystallographica Section B, 2022, 78 |
| 2108998 | CIF | C2 H6 O6 | P 1 21/c 1 | 6.0931; 3.4921; 11.8409 90; 103.842; 90 | 244.63 | Davidson, Max L.; Grabowsky, Simon; Jayatilaka, Dylan X-ray constrained wavefunctions based on Hirshfeld atoms. II. Reproducibility of electron densities in crystals of α-oxalic acid dihydrate Acta Crystallographica Section B, 2022, 78, 397-415 |
| 2108999 | CIF Paper | C5 H5 N3 O | P 1 21/n 1 | 3.5885; 6.7605; 22.434 90; 92.748; 90 | 543.6 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109000 | CIF | C5 H5 N3 O | P 1 21/n 1 | 3.633; 6.753; 22.546 90; 92.39; 90 | 552.7 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109001 | CIF | C5 H5 N3 O | P 1 21/c 1 | 14.3433; 3.6086; 10.6023 90; 100.982; 90 | 538.72 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109002 | CIF | C5 H5 N3 O | P 1 21/c 1 | 14.328; 3.633; 10.628 90; 101.169; 90 | 542.7 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109003 | CIF | C5 H5 N3 O | P 1 c 1 | 7.1818; 3.6295; 10.6533 90; 106.377; 90 | 266.43 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109004 | CIF | C5 H5 N3 O | P 1 c 1 | 7.173; 3.65; 10.686 90; 106.487; 90 | 268.27 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109005 | CIF | C5 H5 N3 O | P -1 | 5.1026; 5.7083; 9.8487 97.526; 98.499; 106.564 | 267.37 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109006 | CIF | C5 H5 N3 O | P -1 | 5.128; 5.708; 9.857 97.45; 98.04; 106.55 | 269.45 | Hoser, Anna Agnieszka; Rekis, Toms; Madsen, Anders Østergaard Dynamics and disorder: on the stability of pyrazinamide polymorphs Acta Crystallographica Section B, 2022, 78, 416-424 |
| 2109007 | CIF HKL | H2 O8 V3 | P n a m | 16.8658; 9.3282; 3.63523 90; 90; 90 | 571.92 | Schoiber, Jürgen; Söllinger, Daniela; Baran, Volodymyr; Diemant, Thomas; Redhammer, Günther J.; Behm, R. Jurgen; Pokrant, Simone Resolving the structure of V~3~O~7~·H~2~O and Mo-substituted V~3~O~7~·H~2~O Acta Crystallographica Section B, 2022, 78 |
| 2109008 | CIF HKL | H2 Mo0.15 O8 V2.85 | P n a m | 16.879; 9.3325; 3.64357 90; 90; 90 | 573.95 | Schoiber, Jürgen; Söllinger, Daniela; Baran, Volodymyr; Diemant, Thomas; Redhammer, Günther J.; Behm, R. Jurgen; Pokrant, Simone Resolving the structure of V~3~O~7~·H~2~O and Mo-substituted V~3~O~7~·H~2~O Acta Crystallographica Section B, 2022, 78 |
| 2109009 | CIF HKL Paper | C31 H50 O3 | P 1 | 7.1158; 13.118; 14.9298 91.25; 91.505; 99.452 | 1373.75 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109010 | CIF HKL | C32 H52 O3 | P 1 | 7.1484; 13.3087; 15.0523 92.456; 94.221; 98.518 | 1410.28 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109011 | CIF HKL | C32 H50.57 O4 | P 1 | 7.1965; 13.3283; 15.0866 92.599; 94.416; 98.623 | 1424.08 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109012 | CIF HKL | C33 H54 O3 | P 1 | 7.1971; 13.5381; 15.4611 94.146; 96.768; 96.674 | 1480.16 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109013 | CIF HKL | C37 H54 O3 | P 1 21 1 | 6.8066; 12.8648; 17.883 90; 94.885; 90 | 1560.25 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109014 | CIF HKL | C37 H52 O4 | P 1 21 1 | 6.7857; 13; 17.8671 90; 94.87; 90 | 1570.44 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109015 | CIF HKL | C34 H56 O3 | P 1 21 1 | 6.8841; 12.2006; 17.7696 90; 89.794; 90 | 1492.46 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109016 | CIF HKL | C34 H54 O4 | P 21 21 21 | 12.1308; 12.7614; 20.027 90; 90; 90 | 3100.3 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109017 | CIF HKL | C34 H54 O4 | P 21 21 21 | 10.7032; 16.2471; 17.3698 90; 90; 90 | 3020.54 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109018 | CIF HKL | C34 H56 O3 | P 21 21 21 | 10.3008; 16.2751; 17.6374 90; 90; 90 | 2956.85 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109019 | CIF HKL | C34 H54 O4 | P 21 21 21 | 10.3043; 16.1852; 17.627 90; 90; 90 | 2939.78 | Langer, Dominik; Wicher, Barbara; Bendzinska-Berus, Wioletta; Bednarczyk-Cwynar, Barbara; Tykarska, Ewa Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives Acta Crystallographica Section B, 2022, 78 |
| 2109020 | CIF HKL Paper | As4 Cl1.33 O16 Pb6.67 | P 1 21 1 | 20.4487; 7.4362; 20.4513 90; 119.953; 90 | 2694.5 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109021 | CIF HKL | As4 Cl1.33 O16 Pb6.67 | P 1 1 21/b | 10.2378; 20.4573; 7.4457 90; 90; 120.039 | 1349.96 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109022 | CIF HKL | As3 Cl O12 Pb5 | P 1 1 21/b | 10.2398; 20.4774; 7.4554 90; 90; 119.981 | 1354.1 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109023 | CIF HKL | As2 Cl0.67 O8 Pb3.33 | P 1 1 21/b | 10.2552; 20.4913; 7.4576 90; 90; 119.993 | 1357.29 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109024 | CIF HKL | As4 Cl1.33 O16 Pb6.67 | P 1 1 21/b | 10.2544; 20.5052; 7.4568 90; 90; 119.971 | 1358.26 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109025 | CIF | As3 Cl O12 Pb5 | P 63/m | 10.2722; 10.2722; 7.4537 90; 90; 120 | 681.13 | Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B, 2022, 78 |
| 2109026 | CIF HKL Paper | C21 H18 N4 O2 Pb S | P 1 21 1 | 7.9341; 8.014; 15.3431 90; 91.259; 90 | 975.34 | Mahmoudi, Ghodrat; García-Santos, Isabel; Pittelkow, Michael; Kamounah, Fadhil S.; Zangrando, Ennio; Babashkina, Maria G.; Frontera, Antonio; Safin, Damir A. The tetrel bonding role in supramolecular aggregation of lead(II) acetate and a thiosemicarbazide derivative Acta Crystallographica Section B, 2022, 78, 685-694 |
| 2109027 | CIF HKL Paper | C2 H8 N O5 P | P 1 21/a 1 | 9.7872; 8.4868; 7.407 90; 100.43; 90 | 605.1 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109028 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.7823; 8.4929; 7.412 90; 100.44; 90 | 605.6 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109029 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.7272; 8.4963; 7.332 90; 100.45; 90 | 595.9 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109030 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.6758; 8.4905; 7.306 90; 100.43; 90 | 590.3 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109031 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.6118; 8.4921; 7.251 90; 100.4; 90 | 582.1 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109032 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.5551; 8.501; 7.182 90; 100.35; 90 | 573.9 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109033 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.4961; 8.5028; 7.127 90; 100.38; 90 | 566 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109034 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.4462; 8.5075; 7.057 90; 100.46; 90 | 557.7 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109035 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.3869; 8.5115; 6.98 90; 100.5; 90 | 548.3 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109036 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.3265; 8.5118; 6.889 90; 100.68; 90 | 537.4 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109037 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.2779; 8.5031; 6.835 90; 100.76; 90 | 529.7 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109038 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.2492; 8.5144; 6.769 90; 100.94; 90 | 523.4 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109039 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.2008; 8.5014; 6.745 90; 100.94; 90 | 518 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109040 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.1703; 8.4987; 6.695 90; 101.01; 90 | 512.2 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109041 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.1302; 8.4972; 6.657 90; 101; 90 | 507 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109042 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.1044; 8.4959; 6.628 90; 100.98; 90 | 503.3 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109043 | CIF HKL | C2 H8 N O5 P | P 1 21/a 1 | 9.07; 8.4856; 6.61 90; 100.98; 90 | 499.4 | Bogdanov, Nikita E.; Korabel'nikov, Dmitry V.; Fedorov, Igor A.; Zakharov, Boris A.; Boldyreva, Elena V. The effect of hydrostatic compression on the crystal structure of glycinium phosphite Acta Crystallographica Section B, 2022, 78 |
| 2109044 | CIF HKL Paper | C23 H30 N2 S | P 1 21/c 1 | 16.4064; 8.7386; 14.8229 90; 104.983; 90 | 2052.9 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109045 | CIF HKL Paper | C23 H30 N2 Se | P b c a | 17.4279; 15.2522; 31.0253 90; 90; 90 | 8247 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109046 | CIF HKL Paper | C25 H33 N3 S | P 1 21/c 1 | 13.0884; 12.976; 14.4293 90; 113.028; 90 | 2255.32 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109047 | CIF HKL Paper | C25 H33 N3 Se | P 1 21/c 1 | 13.1365; 13.3024; 14.2478 90; 113.156; 90 | 2289.18 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109048 | CIF HKL Paper | C23 H30 I2 N2 S | P -1 | 7.9505; 8.5048; 18.2812 81.04; 89.926; 85.125 | 1216.54 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109049 | CIF HKL Paper | C23 H30 I2 N2 Se | P -1 | 8.0282; 8.4305; 18.3525 81.814; 89.706; 85.171 | 1225.08 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109050 | CIF HKL Paper | C23 H30 I4 N2 S | P -1 | 8.3022; 11.351; 15.5656 83.691; 87.18; 75.024 | 1408.1 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109051 | CIF HKL Paper | C23 H30 I4 N2 Se | P 1 21/n 1 | 11.0063; 22.9632; 11.1015 90; 93.024; 90 | 2801.9 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109052 | CIF HKL Paper | C24 H32 Cl2 I4 N2 Se | P -1 | 8.4541; 8.5353; 22.0045 93.258; 90.198; 98.032 | 1569.59 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109053 | CIF HKL Paper | C26 H35 I5 N2 O Se | C 1 2/c 1 | 13.2501; 11.0708; 45.509 90; 96.722; 90 | 6629.8 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109054 | CIF HKL Paper | C29 H41 I3 N2 O S | P -1 | 8.7838; 14.2194; 15.1418 63.522; 74.494; 80.494 | 1628.9 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109055 | CIF HKL Paper | C29 H41 I3 N2 O Se | P -1 | 8.8091; 14.2584; 15.1228 63.952; 74.061; 81.113 | 1639.67 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109056 | CIF HKL Paper | C29 H30 F4 I2 N2 S | P n a 21 | 7.6668; 16.8546; 22.3786 90; 90; 90 | 2891.8 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109057 | CIF HKL Paper | C29 H30 F4 I2 N2 S | P 21 21 21 | 8.208; 12.9974; 27.2463 90; 90; 90 | 2906.71 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109058 | CIF HKL Paper | C29 H30 F4 I2 N2 Se | P 21 21 21 | 8.2583; 12.9953; 27.224 90; 90; 90 | 2921.65 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109059 | CIF HKL | C52 H60 F4 I2 N4 S2 | C 1 2/c 1 | 39.0981; 17.0474; 7.3957 90; 94.344; 90 | 4915.2 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109060 | CIF HKL | C52 H60 F4 I2 N4 Se2 | C 1 2/c 1 | 39.058; 17.2429; 7.4287 90; 94.012; 90 | 4990.8 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109061 | CIF HKL | C52 H60 F4 I2 N4 S2 | P -1 | 7.502; 12.2475; 14.478 104.905; 95.822; 104.609 | 1224.1 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109062 | CIF HKL | C52 H60 F4 I2 N4 Se2 | P -1 | 7.5969; 12.1995; 14.4439 104.613; 95.7464; 104.119 | 1237.43 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109063 | CIF HKL | C52 H60 F4 I2 N4 S2 | P 1 21/c 1 | 13.3377; 15.2129; 13.0613 90; 109.998; 90 | 2490.41 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109064 | CIF HKL Paper | C87 H90 F9 I9 N6 S3 | P 1 21/c 1 | 39.226; 7.9811; 30.341 90; 106.162; 90 | 9123.3 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109065 | CIF HKL Paper | C29 H30 F3 I3 N2 Se | P 1 21/n 1 | 8.0412; 30.07; 12.4774 90; 92.632; 90 | 3013.8 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109066 | CIF HKL Paper | C29 H30 F5 I N2 S | P n a 21 | 7.8472; 16.1751; 21.7956 90; 90; 90 | 2766.5 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109067 | CIF HKL | C76 H60 F25 I5 N4 Se2 | P 1 21/c 1 | 25.9292; 8.0709; 20.4309 90; 113.037; 90 | 3934.6 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109068 | CIF HKL | C24 H30 I2 N2 S | P -1 | 7.917; 11.6457; 15.0306 67.358; 83.953; 72.067 | 1216.73 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109069 | CIF HKL | C48 H60 I4 N4 Se2 | P -1 | 7.9777; 11.7334; 15.0059 67.54; 82.671; 71.632 | 1231.91 | Ragusa, Arianna C.; Peloquin, Andrew J.; Shahani, Marjan M.; Dowling, Keri N.; Golen, James A.; McMillen, Colin D.; Rabinovich, Daniel; Pennington, William T. Heterocyclic 1,3-diazepine-based thiones and selones as versatile halogen-bond acceptors Acta Crystallographica Section B, 2022, 78 |
| 2109070 | CIF HKL | Ca5 Cl O12 V3 | P 63/m | 10.149; 10.149; 6.7957 90; 90; 120 | 606.19 | Matsuura, Mimiko; Okudera, Hiroki Structures of Ca~5~(VO~4~)~3~Cl and Ca~4.78(1)~Na~0.22~(PO~4~)~3~Cl~0.78~: positions of channel anions and repulsion on the anion in apatite-type compounds Acta Crystallographica Section B, 2022, 78 |
| 2109071 | CIF HKL | Ca4.78 Cl0.78 Na0.22 O12 P3 | P 63/m | 9.5773; 9.5773; 6.8033 90; 90; 120 | 540.43 | Matsuura, Mimiko; Okudera, Hiroki Structures of Ca~5~(VO~4~)~3~Cl and Ca~4.78(1)~Na~0.22~(PO~4~)~3~Cl~0.78~: positions of channel anions and repulsion on the anion in apatite-type compounds Acta Crystallographica Section B, 2022, 78 |
| 2109072 | CIF HKL | Hf O3 Pb | I m m a | 5.8522; 8.236; 5.867 90; 90; 90 | 282.8 | Bosak, Alexei; Svitlyk, Volodymyr; Arakcheeva, Alla; Burkovsky, Roman; Diadkin, Vadim; Roleder, Krystian; Chernyshov, Dmitry Incommensurate crystal structure of PbHfO~3~ Acta Crystallographica Section B, 2020, 76, 7-12 |
| 2109073 | CIF HKL Paper | C3 H7 N3 O5 | I 1 2/a 1 | 8.6385; 6.6817; 11.6069 90; 107.466; 90 | 639.061 | Bojarowski, Sławomir Antonii; Gruza, Barbara; Trzybiński, Damian; Kamiński, Radosław; Hoser, Anna Agnieszka; Kumar, Prashant; Woźniak, Krzysztof; Dominiak, Paulina Maria New refinement strategies for a pseudoatom databank – toward rapid electrostatic interaction energy estimations Acta Crystallographica Section B, 2022, 78 |
| 2109074 | CIF HKL | C20 H14 | P 21 21 21 | 8.0808; 8.1662; 20.3821 90; 90; 90 | 1345 | Bojarowski, Sławomir Antonii; Gruza, Barbara; Trzybiński, Damian; Kamiński, Radosław; Hoser, Anna Agnieszka; Kumar, Prashant; Woźniak, Krzysztof; Dominiak, Paulina Maria New refinement strategies for a pseudoatom databank – toward rapid electrostatic interaction energy estimations Acta Crystallographica Section B, 2022, 78 |
| 2109075 | CIF HKL | C20 H14 | P 21 21 21 | 8.1019; 8.1922; 20.442 90; 90; 90 | 1356.8 | Bojarowski, Sławomir Antonii; Gruza, Barbara; Trzybiński, Damian; Kamiński, Radosław; Hoser, Anna Agnieszka; Kumar, Prashant; Woźniak, Krzysztof; Dominiak, Paulina Maria New refinement strategies for a pseudoatom databank – toward rapid electrostatic interaction energy estimations Acta Crystallographica Section B, 2022, 78 |
| 2109076 | CIF | Al0.1 B Fe0.45 Mg2.15 O5 Ti0.3 | P b a m | 9.246; 12.2731; 3.0092 90; 90; 90 | 341.48 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Cherosov, Mikhail A.; Bubnova, Rimma S.; Vagizov, Farit G.; Krzhizhanovskaya, Maria G.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V. X-ray diffraction and Mössbauer spectroscopy study of oxoborate azoproite (Mg,Fe^2+^)~2~(Fe^3+^,Ti,Mg,Al)O~2~(BO~3~): an <i>in situ</i> temperature-dependent investigation (5 {łeq} <i>T</i> {łeq} 1650K) Acta Crystallographica Section B, 2022, 78 |
| 2109077 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5329; 9.9018; 7.0147 90; 100.309; 90 | 378.1 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109078 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5204; 9.8941; 6.9655 90; 100.34; 90 | 374.27 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109079 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.5087; 9.8814; 6.9315 90; 100.379; 90 | 371.13 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109080 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.2831; 9.491; 6.5957 90; 100.623; 90 | 325.05 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109081 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.2524; 9.4479; 6.535 90; 100.664; 90 | 318.69 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109082 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.173; 9.3305; 6.3822 90; 100.777; 90 | 302.61 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109083 | CIF HKL Paper | C2 H5 Br | P 1 21/n 1 | 5.107; 9.206; 6.285 90; 101.08; 90 | 290 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109084 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.85463; 10.1532; 7.2722 90; 102.701; 90 | 421.71 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109085 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.83962; 10.1442; 7.2368 90; 102.705; 90 | 418.2 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109086 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.82719; 10.1348; 7.20284 90; 102.711; 90 | 414.956 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109087 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.5767; 9.7073; 6.8424 90; 102.262; 90 | 361.96 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109088 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.5292; 9.6336; 6.7597 90; 102.209; 90 | 351.92 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109089 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.4696; 9.5403; 6.6492 90; 102.28; 90 | 339.03 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109090 | CIF HKL Paper | C2 H5 I | P 1 21/n 1 | 5.4335; 9.4863; 6.584 90; 102.191; 90 | 331.71 | Bujak, Maciej; Olejniczak, Anna; Podsiadło, Marcin Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study Acta Crystallographica Section B, 2022, 78 |
| 2109091 | CIF HKL Paper | C19 H21 Cl N4 O6 | P -1 | 7.0381; 12.2643; 12.4636 103.215; 97.797; 93.497 | 1032.92 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109092 | CIF HKL | C19 H23 N3 O5 | P 1 21/n 1 | 8.7472; 16.9734; 13.248 90; 94.886; 90 | 1959.78 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109093 | CIF HKL | C21 H25 N3 O4 | P -1 | 6.9734; 11.254; 13.4029 89.949; 82.689; 74.261 | 1003.55 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109094 | CIF HKL | C19 H21 N5 O8 | P 1 21/n 1 | 6.9538; 18.9491; 15.9042 90; 99.261; 90 | 2068.35 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109095 | CIF HKL | C14 H20 N3 O4 | P 1 21/c 1 | 6.9773; 20.6482; 10.5035 90; 98.764; 90 | 1495.56 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109096 | CIF HKL | C19 H22 N4 O6 | P -1 | 6.8701; 12.1647; 12.1779 101.13; 92.818; 105.005 | 959.26 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109097 | CIF | C19 H23 N3 O6 | P 1 21/n 1 | 8.5777; 17.5407; 13.22 90; 96.605; 90 | 1975.86 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109098 | CIF HKL | C45 H52 N6 O13 | C 1 2/c 1 | 41.7; 8.2992; 12.9536 90; 97.033; 90 | 4449.2 | Scheepers, Matthew Clarke; Lemmerer, Andreas Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol Acta Crystallographica Section B, 2022, 78 |
| 2109099 | CIF HKL Paper | Al8 Cl7 Cu24 Li4.19 Na19.81 O105 P24 | C 1 2/m 1 | 13.3428; 18.932; 8.9404 90; 90.361; 90 | 2258.35 | Yakubovich, Olga V.; Kiriukhina, Galina V.; Simonov, Sergey V.; Volkov, Anatoly S.; Dimitrova, Olga V. (Na,Li)~3~(Cl,OH)[Cu~3~OAl(PO~4~)~3~]: a first salt-inclusion aluminophosphate oxocuprate with a new type of crystal structure Acta Crystallographica Section B, 2023, 79, 24-31 |
| 2109100 | CIF HKL | H5 Nd O8 Se2 | P 1 21/c 1 | 7.0815; 6.6996; 16.7734 90; 101.256; 90 | 780.48 | Murtazoev, Alisher F.; Berdonosov, Peter S.; Aksenov, Sergey M.; Kuznetsov, Alexey N.; Dolgikh, Valery A.; Nelyubina, Yulia V.; Merlino, Stefano Polytypism of Ln(SeO<sub>3</sub>)(HSeO<sub>3</sub>)·2H<sub>2</sub>O compounds: synthesis and crystal structure of the first monoclinic modification of Nd(SeO<sub>3</sub>)(HSeO<sub>3</sub>)·2H<sub>2</sub>O, DFT calculations and order/disorder description. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 176-183 |
| 2109101 | CIF HKL Paper | Ba2 O8 Si2 Ti | P 4 b m | 8.5104; 8.5104; 5.1975 90; 90; 90 | 376.44 | Chukanov, Nikita V.; Kazheva, Olga N.; Fischer, Reinhard X.; Aksenov, Sergey M. Refinement of the crystal structure of fresnoite, Ba<sub>2</sub>TiSi<sub>2</sub>O<sub>8</sub>, from Löhley (Eifel district, Germany); Gladstone-Dale compatibility, electronic polarizability and vibrational spectroscopy of minerals and inorganic compounds with pentacoordinated Ti<sup>IV</sup> and a titanyl bond. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 184-194 |
| 2310026 | CIF Paper | Cl4 Rb2 Zn | Pmcn(00\g)ss0 | 7.241; 12.648; 9.216 90; 90; 90 | 844.04 | Li, Liang; Wölfel, Alexander; Schönleber, Andreas; Mondal, Swastik; Schreurs, Antoine M. M.; Kroon-Batenburg, Loes M. J.; van Smaalen, Sander Modulated anharmonic ADPs are intrinsic to aperiodic crystals: a case study on incommensurate Rb~2~ZnCl~4~ Acta Crystallographica Section B, 2011, 67, 205-217 |
| 2310027 | CIF Paper | Cl4 Rb2 Zn | Pmcn(00\g)ss0 | 7.241; 12.648; 9.216 90; 90; 90 | 844.04 | Li, Liang; Wölfel, Alexander; Schönleber, Andreas; Mondal, Swastik; Schreurs, Antoine M. M.; Kroon-Batenburg, Loes M. J.; van Smaalen, Sander Modulated anharmonic ADPs are intrinsic to aperiodic crystals: a case study on incommensurate Rb~2~ZnCl~4~ Acta Crystallographica Section B, 2011, 67, 205-217 |
| 2310028 | CIF Paper | Sb8 Te3 | R-3m(00\g) | 4.3134; 4.3134; 5.8658 90; 90; 120 | 94.514 | Kifune, Kouichi; Fujita, Tomoko; Kubota, Yoshiki; Yamada, Noboru; Matsunaga, Toshiyuki Crystallization of the chalcogenide compound Sb~8~Te~3~ Acta Crystallographica Section B, 2011, 67, 381-385 |
| 2310029 | CIF Paper | Ba0.721 Ca0.251 Ce0.024 Nb2 O6 | X4bm | 12.4596; 12.4596; 7.9042 90; 90; 90 | 1227.06 | Graetsch, Heribert A.; Pandey, Chandra Shekhar; Schreuer, Jürgen; Burianek, Manfred; Mühlberg, Manfred Incommensurate modulation of calcium barium niobate (CBN28 and Ce:CBN28) Acta Crystallographica Section B, 2012, 68, 101-106 |
| 2310030 | CIF Paper | Ba0.72 Ca0.279 Nb2 O6 | X4bm | 12.4529; 12.4529; 7.9242 90; 90; 90 | 1228.84 | Graetsch, Heribert A.; Pandey, Chandra Shekhar; Schreuer, Jürgen; Burianek, Manfred; Mühlberg, Manfred Incommensurate modulation of calcium barium niobate (CBN28 and Ce:CBN28) Acta Crystallographica Section B, 2012, 68, 101-106 |
| 2310031 | CIF Paper | Ga0.889 O4.222 Zn2.889 | C2/m(\a0\g)00 | 19.66; 3.2487; 1.6065 90; 105.9; 90 | 98.7 | Michiue, Yuichi; Kimizuka, Noboru; Kanke, Yasushi; Mori, Takao Structure of (Ga~2~O~3~)~2~(ZnO)~13~ and a unified description of the homologous series (Ga~2~O~3~)~2~(ZnO)~2~~<i>n~+1</i> Acta Crystallographica Section B, 2012, 68, 250-260 |
| 2310032 | CIF Paper | Ca Mn7 O12 | R-3(00\g)0 | 10.44365; 10.44365; 6.343562 90; 90; 120 | 599.195 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310033 | CIF Paper | Ca Mn7 O12 | R3(00\g)t | 10.443658; 10.443658; 6.343562 90; 90; 120 | 599.196 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310034 | CIF Paper | Ca Mn7 O12 | R31(00\g)ts | 10.4372; 10.4372; 6.3414 90; 90; 120 | 598.25 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310035 | CIF Paper | Ca Cu0.113 Mn6.887 O12 | R31(00\g)ts | 10.4312; 10.4312; 6.3417 90; 90; 120 | 597.59 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310036 | CIF Paper | Ca Mn7 O12 | R31(00\g)ts | 10.4452; 10.4452; 6.3453 90; 90; 120 | 599.54 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310037 | CIF Paper | Ca Cu0.246 Mn6.754 O12 | R31(00\g)ts | 10.403; 10.403; 6.334 90; 90; 120 | 593.6 | Sławiński, W.; Przeniosło, R.; Sosnowska, I.; Petříček, V. Helical screw type magnetic structure of the multiferroic CaMn~7~O~12~ with low Cu-doping Acta Crystallographica Section B, 2012, 68, 240-249 |
| 2310038 | CIF Paper | Bi14 Fe12 O61 Sr21 | X2/m(\a0\g)0s | 3.5905; 5.4903; 3.4954 90; 81.8989; 90 | 68.217 | Elcoro, Luis; Pérez, Olivier; Perez-Mato, J. M.; Petříček, Václav Unified (3+1)-dimensional superspace description of the 2212-type stair-like [Bi~2~Sr~3~Fe~2~O~9~]~<i>m~</i>[Bi~4~Sr~6~Fe~2~O~16~] family of compounds Acta Crystallographica Section B, 2012, 68, 341-355 |
| 2310039 | CIF Paper | Bi0.737 Mo0.263 O1.895 | F2(\a0\g)0 | 5.66785; 5.64098; 5.45603 90; 89.6677; 90 | 174.439 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 2310040 | CIF Paper | Bi0.75 Mo0.25 O1.875 | F2/m(\a0\g)0s | 5.70284; 5.64841; 5.46579 90; 89.5999; 90 | 176.06 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 2310041 | CIF Paper | Bi0.769 Mo0.231 O1.846 | F2(\a0\g)0 | 5.76634; 5.64745; 5.46529 90; 89.7935; 90 | 177.977 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 2310042 | CIF Paper | Bi0.727 Mo0.273 O1.909 | F2/m(\a0\g)0s | 5.64477; 5.63038; 5.4499 90; 89.7498; 90 | 173.208 | Bereciartua, P. J.; Zuñiga, F. J.; Perez-Mato, J. M.; Petříček, V.; Vila, E.; Castro, A.; Rodríguez-Carvajal, J.; Doyle, S. Structure refinement and superspace description of the system Bi~2(<i>n~+2)</i>Mo~<i>n~</i>O~6(<i>n~+1)</i> (<i>n</i> = 3, 4, 5 and 6) Acta Crystallographica Section B, 2012, 68, 323-340 |
| 2310043 | CIF Paper | Bi12 Fe10 O52 Sr18 | X2/m(\a0\g)0s | 3.6174; 5.48; 3.4641 90; 81.2438; 90 | 67.87 | Elcoro, Luis; Pérez, Olivier; Perez-Mato, J. M.; Petříček, Václav Unified (3+1)-dimensional superspace description of the 2212-type stair-like [Bi~2~Sr~3~Fe~2~O~9~]~<i>m~</i>[Bi~4~Sr~6~Fe~2~O~16~] family of compounds Acta Crystallographica Section B, 2012, 68, 341-355 |
| 2310050 | CIF Paper | Ag0.034 In0.037 Sb0.764 Te0.165 | R-3m(00\g)00 | 4.3037; 4.3037; 5.6452 90; 90; 120 | 90.551 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 2310057 | CIF Paper | Sb0.87 Te0.13 | R-3m(00\g)00 | 4.3181; 4.3181; 5.7267 90; 90; 120 | 92.474 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 2310058 | CIF Paper | Sb0.89 Te0.11 | R-3m(00\g)00 | 4.29686; 4.29686; 5.6759 90; 90; 120 | 90.754 | Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kubota, Yoshiki; Kifune, Kouichi Structural transformation of Sb-based high-speed phase-change material Acta Crystallographica Section B, 2012, 68, 559-570 |
| 2310129 | CIF HKL Paper | C6 H8 O2 | C 1 2/m 1 | 12.402; 6.47; 6.321 90; 93.69; 90 | 506.2 | Nassour, Ayoub; Kubicki, Maciej; Wright, Jonathan; Borowiak, Teresa; Dutkiewicz, Grzegorz; Lecomte, Claude; Jelsch, Christian Charge-density analysis using multipolar atom and spherical charge models: 2-methyl-1,3-cyclopentanedione, a compound displaying a resonance-assisted hydrogen bond. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 197-211 |
| 2310153 | CIF HKL Paper | C32 H36 N8 O7 S | P -1 | 8.4454; 10.9223; 18.4436 90.268; 94.002; 106.255 | 1628.78 | van de Streek, Jacco Structure of Pigment Yellow 181 dimethylsulfoxide N-methyl-2-pyrrolidone (1:1:1) solvate from XRPD + DFT-D. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 89-94 |
| 2310154 | CIF HKL Paper | As39.51 Pb6.13 S136 Sb41.51 Tl16.85 | P 1 | 8.5197; 42.461; 16.293 83.351; 90.958; 84.275 | 5823 | Biagioni, Cristian; Moëlo, Yves; Favreau, Georges; Bourgoin, Vincent; Boulliard, Jean Claude Structure of Pb-rich chabournéite from Jas Roux, France. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 81-88 |
| 2310155 | CIF HKL Paper | C0.6 O49.2 Si24 | P 1 21/n 1 | 13.376; 20.111; 19.878 90; 90.003; 90 | 5347.3 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310156 | CIF HKL Paper | C0.14 O48.27 Si24 | P 1 21/n 1 | 13.383; 20.118; 19.887 90; 90.049; 90 | 5354.4 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310157 | CIF HKL Paper | C0.6 O49.2 Si24 | P 1 21/n 1 | 13.388; 20.132; 19.902 90; 90.04; 90 | 5364.1 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310158 | CIF HKL Paper | C1.1 O50.2 Si24 | P 1 21/n 1 | 13.383; 20.121; 19.881 90; 90.057; 90 | 5353.5 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310159 | CIF HKL Paper | C1.1 O48.5 Si24 | P 1 21/n 1 | 13.386; 20.106; 19.881 90; 90.02; 90 | 5350.8 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310160 | CIF HKL Paper | C2 O49 Si24 | P 1 21/n 1 | 13.381; 20.107; 19.875 90; 90.023; 90 | 5347.4 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310161 | CIF HKL Paper | C0.4 O48.2 Si24 | P 1 21/n 1 | 13.383; 20.108; 19.877 90; 90.003; 90 | 5349 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310162 | CIF HKL Paper | C0.5 O48.2 Si24 | P 1 21/n 1 | 13.385; 20.11; 19.881 90; 90.041; 90 | 5351.4 | Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118 |
| 2310163 | CIF HKL Paper | C4 H16 Ca O12 | P 21 21 2 | 7.739; 12.803; 5.829 90; 90; 90 | 577.551 | Ventruti, Gennaro; Scordari, Fernando; Bellatreccia, Fabio; Della Ventura, Giancarlo; Sodo, Armida Calcium tartrate esahydrate, CaC4H4O6·6H2O: a structural and spectroscopic study. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 68-73 |
| 2310735 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.827; 5.218; 5.537 90; 90; 90.02 | 226.1 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310736 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8266; 5.2203; 5.5404 90; 90; 89.988 | 226.37 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310737 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8295; 5.2213; 5.5418 90; 90; 89.994 | 226.55 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310738 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8339; 5.2222; 5.5444 90; 90; 90.007 | 226.82 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310739 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.837; 5.2237; 5.5459 90; 90; 90.001 | 227.04 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310740 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8394; 5.2244; 5.5468 90; 90; 89.997 | 227.18 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310741 | CIF Paper | Fe0.615 La3.333 O11.333 Ti2.718 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8422; 5.2254; 5.5484 90; 90; 89.998 | 227.37 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310742 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.821; 5.2697; 5.5468 90; 90; 90.02 | 228.61 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310743 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8248; 5.2721; 5.5483 90; 90; 90.007 | 228.88 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310744 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8267; 5.2714; 5.5503 90; 90; 90.019 | 228.99 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310745 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8302; 5.2737; 5.5518 90; 90; 90.001 | 229.26 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310746 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8367; 5.2775; 5.5561 90; 90; 90.044 | 229.79 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310747 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8339; 5.2752; 5.552 90; 90; 89.99 | 229.44 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310748 | CIF Paper | Fe0.571 La3.429 O11.429 Ti2.858 | P 1 21/c 1 (2*c,2*a+c,b) | 7.8379; 5.2768; 5.5545 90; 90; 89.996 | 229.73 | Wölfel, Alexander; Dorscht, Philipp; Lichtenberg, Frank; van Smaalen, Sander Anisotropic thermal expansion of La(n)(Ti,Fe)(n)O(3n + 2) (n = 5 and 6) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2013, 69, 137-144 |
| 2310756 | CIF | F Mg2 O4 P | P 1 21/n 1 | 12.7628; 12.6564; 9.6348 90; 117.6; 90 | 1379.22 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310757 | CIF | F Fe1.078 Mg0.922 O4 P | C 1 2/c 1 | 13.0183; 6.4149; 9.8411 90; 118.562; 90 | 721.823 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310758 | CIF | F Fe0.649 Mg1.351 O4 P | C 1 2/c 1 | 12.884; 6.3889; 9.7384 90; 117.799; 90 | 709.098 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310759 | CIF | F Fe0.185 Mg1.815 O4 P | C 1 2/c 1 | 12.7978; 6.3523; 9.6642 90; 117.567; 90 | 696.46 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310760 | CIF | F Fe0.029 Mg1.971 O4 P | C 1 2/c 1 | 12.7707; 6.3394; 9.6462 90; 117.524; 90 | 692.553 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310761 | CIF | F Fe0 Mg2 O4 P | C 1 2/c 1 | 12.7633; 6.3282; 9.635 90; 117.599; 90 | 689.66 | Lazic, Biljana; Armbruster, Thomas; Chopin, Christian; Grew, Edward S.; Baronnet, Alain; Palatinus, Lukas Superspace description of wagnerite-group minerals (Mg,Fe,Mn)2(PO4)(F,OH) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 243-258 |
| 2310762 | CIF Paper | Ba0.761 Ca0.239 Nb2 O6 | C m m 2 (2*c,a,b) | 7.9429; 17.624; 17.6229 90; 90; 90 | 2466.95 | Graetsch, Heribert A.; Pandey, Chandra Shehkar; Schreuer, Jürgen; Burianek, Manfred; Mühlberg, Manfred Incommensurate modulations of relaxor ferroelectric Ca0.24Ba0.76Nb2O6 (CBN24) and Ca0.31Ba0.69Nb2O6 (CBN31) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 743-749 |
| 2310763 | CIF Paper | Ba0.761 Ca0.239 Nb2 O6 | P 4 b m (a,b,2*c) | 12.4476; 12.4476; 7.9291 90; 90; 90 | 1228.56 | Graetsch, Heribert A.; Pandey, Chandra Shehkar; Schreuer, Jürgen; Burianek, Manfred; Mühlberg, Manfred Incommensurate modulations of relaxor ferroelectric Ca0.24Ba0.76Nb2O6 (CBN24) and Ca0.31Ba0.69Nb2O6 (CBN31) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 743-749 |
| 2310764 | CIF Paper | Ba0.693 Ca0.307 Nb2 O6 | P 4 b m (a,b,2*c) | 12.4608; 12.4608; 7.9185 90; 90; 90 | 1229.52 | Graetsch, Heribert A.; Pandey, Chandra Shehkar; Schreuer, Jürgen; Burianek, Manfred; Mühlberg, Manfred Incommensurate modulations of relaxor ferroelectric Ca0.24Ba0.76Nb2O6 (CBN24) and Ca0.31Ba0.69Nb2O6 (CBN31) Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 743-749 |
| 2310765 | CIF Paper | C17 H22 F N O2 | P 1 21/n 1 | 10.8498; 6.5247; 21.3826 90; 98.246; 90 | 1498.06 | Schönleber, Andreas; van Smaalen, Sander; Weiss, Hans Christoph; Kesel, Andreas J. N-H...O and C-H...F hydrogen bonds in the incommensurately modulated crystal structure of adamantan-1-ammonium 4-fluorobenzoate. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 652-659 |
| 2310766 | CIF Paper | C18 H10 Cl2 N2 O4 | P 1 21 1 | 12.372; 3.7649; 16.831 90; 107.789; 90 | 746.49 | Noohinejad, Leila; Mondal, Swastik; Ali, Sk Imran; Dey, Somnath; van Smaalen, Sander; Schönleber, Andreas Resonance-stabilized partial proton transfer in hydrogen bonds of incommensurate phenazine-chloranilic acid Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 228-234 |
| 2310767 | CIF Paper | B3.041 O10.479 Si0.959 Sr4 | P n m a | 12.2774; 3.9006; 5.4091 90; 90; 90 | 259.038 | Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497 |
| 2310768 | CIF Paper | B3.376 O10.312 Si0.624 Sr4 | P n m a | 12.178; 3.8801; 5.387 90; 90; 90 | 254.55 | Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497 |
| 2310769 | CIF Paper | B3.704 O10.148 Si0.296 Sr4 | P n m a | 12.089; 3.8635; 5.378 90; 90; 90 | 251.184 | Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497 |
| 2310770 | CIF Paper | Cu3 Sn | C m c m | 5.521; 47.781; 4.334 90; 90; 90 | 1143.3 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310771 | CIF Paper | Cu3 Sn | C m c m | 5.5185; 47.768; 4.332 90; 90; 90 | 1141.95 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310772 | CIF Paper | Cu3 Sn | C m c m | 5.5196; 38.2386; 4.3321 90; 90; 90 | 914.34 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310773 | CIF Paper | Cu3 Sn | C m c m | 5.5184; 38.2337; 4.3326 90; 90; 90 | 914.13 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310774 | CIF Paper | Cu3 Sn | C m c m | 5.5199; 47.7904; 4.3326 90; 90; 90 | 1142.93 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310775 | CIF Paper | Cu3.048 Sn0.952 | P m m a (2*b+1/4,c,a-1/3) | 5.528; 4.783; 4.3391 90; 90; 90 | 114.73 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310776 | CIF Paper | Cu3.027 Sn0.973 | P m m a (2*b+1/4,c,a-1/3) | 5.525; 4.781; 4.3385 90; 90; 90 | 114.6 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310777 | CIF Paper | Cu3.031 Sn0.969 | P m m a (2*b+1/4,c,a-1/3) | 5.529; 4.787; 4.3381 90; 90; 90 | 114.82 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310778 | CIF Paper | Cu3.022 Sn0.978 | P m m a (2*b+1/4,c,a-1/3) | 5.523; 4.783; 4.336 90; 90; 90 | 114.54 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310779 | CIF Paper | Cu3.013 Sn0.987 | P m m a (2*b,c,a) | 5.529; 4.788; 4.3411 90; 90; 90 | 114.92 | Müller, Carola J; Lidin, Sven Cu~3~Sn - understanding the systematic absences. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 879-887 |
| 2310780 | CIF Paper | Bi0.097 Fe1.049 O2.585 Pb0.856 | I 1 2/m 1 | 3.93492; 3.93193; 4.00171 90; 92.603; 90 | 61.85 | Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke Synergy between transmission electron microscopy and powder diffraction: application to modulated structures. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143 |
| 2310781 | CIF Paper | Bi0.195 Fe1.046 O2.633 Pb0.763 | I 1 2/m 1 | 3.92822; 3.92661; 4.05202 90; 92.209; 90 | 62.454 | Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke Synergy between transmission electron microscopy and powder diffraction: application to modulated structures. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143 |
| 2310782 | CIF Paper | Bi0.292 Fe1.042 O2.675 Pb0.671 | I 1 2/m 1 | 3.92131; 3.91951; 4.09255 90; 91.913; 90 | 62.866 | Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke Synergy between transmission electron microscopy and powder diffraction: application to modulated structures. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143 |
| 2310783 | CIF Paper | Bi0.428 Fe1.034 O2.736 Pb0.541 | I 1 2/m 1 | 3.9146; 3.91271; 4.13775 90; 91.554; 90 | 63.353 | Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke Synergy between transmission electron microscopy and powder diffraction: application to modulated structures. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143 |
| 2310784 | CIF Paper | Bi0.545 Fe1.027 O2.783 Pb0.428 | I 1 2/m 1 | 3.90908; 3.90585; 4.16564 90; 91.318; 90 | 63.585 | Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke Synergy between transmission electron microscopy and powder diffraction: application to modulated structures. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143 |
| 2310785 | CIF Paper | Al4.8 O9.6 Si1.2 | P b a m | 7.5911; 7.6924; 2.8899 90; 90; 90 | 168.752 | Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X. The modulated average structure of mullite. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 358-368 |
| 2310786 | CIF Paper | Al4.78 O9.61 Si1.22 | P b a m | 7.5757; 7.6651; 2.885 90; 90; 90 | 167.528 | Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X. The modulated average structure of mullite. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 358-368 |
| 2310787 | CIF | O7 P2 Zn2 | I 1 2/c 1 | 20.1131; 8.2769; 9.109 90; 106.338; 90 | 1455.2 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310788 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6082; 8.2821; 4.5238 90; 105.439; 90 | 238.652 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310789 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6053; 8.2821; 4.5243 90; 105.416; 90 | 238.6 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310790 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6041; 8.2827; 4.5249 90; 105.406; 90 | 238.617 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310791 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6036; 8.283; 4.525 90; 105.403; 90 | 238.617 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310792 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6025; 8.2826; 4.5251 90; 105.4; 90 | 238.575 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310793 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6018; 8.2835; 4.526 90; 105.391; 90 | 238.633 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310794 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.6011; 8.2839; 4.5266 90; 105.387; 90 | 238.655 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2310795 | CIF | O7 P2 Zn2 | C 1 2/m 1 | 6.5998; 8.2845; 4.53 90; 105.335; 90 | 238.86 | Stöger, Berthold; Weil, Matthias; Dušek, Michal The α ↔ β phase transitions of Zn2P2O7 revisited: existence of an additional intermediate phase with an incommensurately modulated structure. Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2014, 70, 539-554 |
| 2311256 | CIF | C21 H26 N2 O3 | P 21 21 21 | 7.633; 14.455; 16.504 90; 90; 90 | 1821 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311257 | CIF | C18 H25 O2.5 | P 21 21 2 | 12.056; 19.225; 6.519 90; 90; 90 | 1511 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311258 | CIF | C5 H10 N2 O3 | P 21 21 21 | 5.094; 7.745; 15.941 90; 90; 90 | 628.9 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311259 | CIF | C21 H22 N2 | P 21 21 21 | 8.54; 11.086; 17.344 90; 90; 90 | 1642 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311260 | CIF | C21 H29 N3 | P 21 21 21 | 8.513; 11.527; 17.855 90; 90; 90 | 1752.1 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311261 | CIF | C3 H7 N O2 | P 21 21 21 | 5.791; 5.944; 12.269 90; 90; 90 | 422.3 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311262 | CIF | C19 H26 N6 O | P 21 21 21 | 11.25751; 15.43442; 22.52516 90; 90; 90 | 3913.82 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311263 | CIF | C14 H19 N O | P 21 21 21 | 6.816; 8.446; 21.186 90; 90; 90 | 1219.6 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311264 | CIF | C16 H18 N2 | P 1 21 1 | 8.529; 12.793; 12.018 90; 94.386; 90 | 1307.5 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311265 | CIF | C16 H18 N2 | P 32 | 11.7721; 11.7721; 8.0824 90; 90; 120 | 970.02 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311266 | CIF | C19 H18 N2 | P 31 | 12.094; 12.094; 8.551 90; 90; 120 | 1083.1 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311267 | CIF | C21 H22 N2 | P 21 21 21 | 6.0196; 12.7041; 21.6151 90; 90; 90 | 1652.98 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311268 | CIF | C16 H20 N2 O | P 21 21 21 | 8.695; 10.114; 15.544 90; 90; 90 | 1367 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311269 | CIF | C25 H31 N O5 | P 21 21 21 | 8.414; 13.76; 19.299 90; 90; 90 | 2234.4 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311270 | CIF | C27 H48 | P 1 21 1 | 11.375; 10.878; 19.501 90; 104.237; 90 | 2338.9 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311271 | CIF | C19 H26 N6 O | P 21 21 21 | 11.25467; 15.43831; 22.51824 90; 90; 90 | 3912.61 | Parsons, Simon; Flack, Howard D.; Wagner, Trixie Use of intensity quotients and differences in absolute structure refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2013, 69, 249-259 |
| 2311272 | CIF Paper | H18 Mg O13 Se | P 1 21/c 1 | 7.2223; 10.483; 17.327 90; 109.573; 90 | 1236 | Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J. Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327 |
| 2311273 | CIF Paper | H18 Mg O13 Se | P 1 21/c 1 | 7.2264; 10.487; 17.33 90; 109.579; 90 | 1237.4 | Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J. Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327 |
| 2311274 | CIF Paper | H18 Mg O13 Se | P 1 21/c 1 | 7.2389; 10.497; 17.349 90; 109.522; 90 | 1242.5 | Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J. Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327 |
| 2311275 | CIF Paper | H18 Mg O13 Se | P 1 21/c 1 | 7.2604; 10.502; 17.388 90; 109.423; 90 | 1250.4 | Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J. Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327 |
| 2311276 | CIF | C21 H35 Cl N O2 P2 Re | P 1 21/c 1 | 9.6475; 10.7392; 25.629 90; 68.684; 90 | 2473.7 | Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Non-order-disorder allotwinning of the rhenium pincer complex cis-Re[(PNP<sup>CH<sub>2</sub></sup>-iPr)(CO)<sub>2</sub>Cl]. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 941-949 |
| 2311277 | CIF | C21 H35 Cl N O2 P2 Re | I 1 2/a 1 | 18.6854; 10.7708; 25.599 90; 107.48; 90 | 4914.1 | Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Non-order-disorder allotwinning of the rhenium pincer complex cis-Re[(PNP<sup>CH<sub>2</sub></sup>-iPr)(CO)<sub>2</sub>Cl]. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 941-949 |
| 2311629 | CIF | C19 H20 Cl N O6 | P 1 21 1 | 11.783; 8.5387; 19.297 90; 96.03; 90 | 1930.8 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311630 | CIF | C18 H20 Cl N O8 | P 21 21 21 | 8.5456; 11.74; 19.269 90; 90; 90 | 1933.2 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311631 | CIF | C18 H19.5 Cl N0.5 O7 | P 21 21 21 | 8.6852; 15.047; 27.605 90; 90; 90 | 3607.6 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311632 | CIF | C19 H22 Cl N O8 | C 1 2 1 | 21.931; 8.6541; 11.797 90; 117.57; 90 | 1984.7 | Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H. Solvates of the antifungal drug griseofulvin: structural, thermochemical and conformational analysis. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 54-62 |
| 2311633 | CIF Paper | C6 F10 | P 1 21/n 1 | 11.9302; 7.2371; 9.6574 90; 113.408; 90 | 765.2 | Solovyov, Leonid A.; Fedorov, Alexandr S.; Kuzubov, Aleksandr A. Complete crystal structure of decafluorocyclohex-1-ene at 4.2 K from original neutron diffraction data. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 395-397 |
| 2311634 | CIF Paper | C13 H10 N4 | P 1 21/c 1 | 22.6348; 5.825; 17.8421 90; 113.007; 90 | 2165.32 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311635 | CIF | C13 H9 F N4 | P 1 21/c 1 | 12.2031; 7.9798; 11.6329 90; 104.043; 90 | 1098.94 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311636 | CIF | C13 H9 Cl N4 | C 1 2/c 1 | 16; 5.9258; 24.3829 90; 93.109; 90 | 2308.4 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311637 | CIF | C14 H12 N4 | P 1 21 1 | 5.7797; 6.7414; 15.0259 90; 92.359; 90 | 584.96 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311638 | CIF | C14 H9 F3 N4 | P -1 | 5.746; 7.2076; 15.2997 103.045; 98.768; 92.29 | 608.25 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311639 | CIF | C14 H9 N5 | C 1 2/c 1 | 16.0427; 5.8677; 24.487 90; 92.354; 90 | 2303.1 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311640 | CIF | C14 H12 N4 O | P 1 | 3.7837; 10.8502; 15.22 109.226; 97.056; 91.514 | 584.03 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311641 | CIF Paper | C14 H10 N4 O2 | P 1 21/c 1 | 10.597; 14.471; 7.7343 90; 90.121; 90 | 1186 | Tawfiq, Kinaan M.; Miller, Gary J.; Al-Jeboori, Mohamad J; Fennell, Paul S.; Coles, Simon J.; Tizzard, Graham J.; Wilson, Claire; Potgieter, Herman Comparison of the structural motifs and packing arrangements of six novel derivatives and one polymorph of 2-(1-phenyl-1H-1,2,3-triazol-4-yl)pyridine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 379-389 |
| 2311642 | CIF Paper | C20 H18 Cl2 F3 N3 O2 S | P -1 | 7.7005; 11.2405; 13.7322 111.249; 90.907; 99.769 | 1087.88 | Panini, Piyush; Venugopala, K. N.; Odhav, Bharti; Chopra, Deepak Polymorphism in two biologically active dihydropyrimidinium hydrochloride derivatives: quantitative inputs towards the energetics associated with crystal packing. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 681-696 |
| 2311643 | CIF | C19 H20 Br Cl2 N3 O3 | P 1 21/c 1 | 14.8702; 8.091; 17.7304 90; 92.203; 90 | 2131.7 | Panini, Piyush; Venugopala, K. N.; Odhav, Bharti; Chopra, Deepak Polymorphism in two biologically active dihydropyrimidinium hydrochloride derivatives: quantitative inputs towards the energetics associated with crystal packing. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 681-696 |
| 2311644 | CIF Paper | C44 H56 F2 N6 O14 | P -1 | 9.4994; 14.3694; 18.1458 103.853; 96.528; 106.946 | 2255.11 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311645 | CIF | C41 H57 F2 N6 O21 | P -1 | 7.4031; 9.7515; 30.9801 88.088; 85.673; 81.38 | 2204.38 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311646 | CIF | C23 H26 F N3 O7 | P 1 21/c 1 | 8.0761; 14.7184; 18.777 90; 99.269; 90 | 2202.83 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311647 | CIF | C21 H30 F N3 O10 S | P -1 | 9.041; 10.767; 12.438 89.118; 81.88; 74.64 | 1155.5 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311648 | CIF | C26 H23 F N3 O10 S | P b c a | 11.6515; 7.4209; 61.8325 90; 90; 90 | 5346.3 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311649 | CIF | C23 H26 F N3 O7 | P -1 | 7.0237; 9.9645; 17.4655 91.1; 97.543; 109.906 | 1136.71 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311650 | CIF | C23 H26 F N3 O7 | P -1 | 7.3258; 19.8297; 23.9108 96.924; 97.21; 96.143 | 3394.48 | Xu, Yun; Jiang, Linglei; Mei, Xuefeng Supramolecular structures and physicochemical properties of norfloxacin salts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 750-760 |
| 2311651 | CIF | C6 H10 O4 | C 1 2/c 1 | 12.555; 6.16; 14.163 90; 139.71; 90 | 708.3 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311652 | CIF | C8 H14 O4 | C 1 2/c 1 | 11.953; 8.714; 9.039 90; 98.367; 90 | 931.5 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311653 | CIF | C10 H18 O4 | P -1 | 4.3722; 7.829; 8.718 113.011; 90.935; 97.047 | 271.92 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311654 | CIF | C12 H22 O4 | P 1 21/c 1 | 10.64; 4.2351; 15.758 90; 112.61; 90 | 655.5 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311655 | CIF | C10 H14 O4 | P 1 21/c 1 | 8.808; 8.553; 6.86 90; 97.58; 90 | 512.3 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311656 | CIF | C18 H18 O4 | P b c a | 10.219; 8.26; 17.923 90; 90; 90 | 1512.9 | Joseph, Sumy; Sathishkumar, Ranganathan Succinate esters: odd-even effects in melting points. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 839-846 |
| 2311657 | CIF Paper | C42 H46 N2 Ni O4 P2 S4 | P 1 21/n 1 | 11.7905; 14.4443; 12.8825 90; 105.195; 90 | 2117.26 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Geeta; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural characterization of donor-stabilized disubstituted diphenyldithiophosphates of nickel(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 761-767 |
| 2311658 | CIF | C46 H54 N2 Ni O4 P2 S4 | P -1 | 9.5505; 9.801; 14.2026 99.315; 98.447; 112.821 | 1176.64 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Geeta; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural characterization of donor-stabilized disubstituted diphenyldithiophosphates of nickel(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 761-767 |
| 2311659 | CIF | C46 H54 N2 Ni O4 P2 S4 | P -1 | 6.9327; 11.2267; 15.5768 102.744; 94.409; 103.785 | 1137.67 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Geeta; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural characterization of donor-stabilized disubstituted diphenyldithiophosphates of nickel(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 761-767 |
| 2311660 | CIF Paper | C23 H22 N2 O2 | P 1 21/c 1 | 4.81; 20.601; 18.831 90; 91.95; 90 | 1864.9 | Kaczmarek, Małgorzata T; Kubicki, Maciej The trimorphic structure of N,N'-bis(5-methylsalicylidene)-4-methyl-1,3-phenylenediamine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 792-800 |
| 2311661 | CIF | C23 H22 N2 O2 | P 1 21/c 1 | 21.694; 12.599; 21.236 90; 93.38; 90 | 5794.2 | Kaczmarek, Małgorzata T; Kubicki, Maciej The trimorphic structure of N,N'-bis(5-methylsalicylidene)-4-methyl-1,3-phenylenediamine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 792-800 |
| 2311662 | CIF | C23 H22 N2 O2 | P 1 21 1 | 9.464; 20.64; 19.219 90; 103.93; 90 | 3643.8 | Kaczmarek, Małgorzata T; Kubicki, Maciej The trimorphic structure of N,N'-bis(5-methylsalicylidene)-4-methyl-1,3-phenylenediamine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 792-800 |
| 2311663 | CIF Paper | C5 H4 Fe N6 Na2 O3 | P n n m | 6.14102; 11.8451; 15.5509 90; 90; 90 | 1131.19 | Wenger, Emmanuel; Dahaoui, Slimane; Alle, Paul; Parois, Pascal; Palin, Cyril; Lecomte, Claude; Schaniel, Dominik XPAD X-ray hybrid pixel detector for charge density quality diffracted intensities on laboratory equipment. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 783-791 |
| 2311664 | CIF Paper | C4 H11 N O10 | P -1 | 6.2372; 7.1935; 10.4745 94.5207; 99.8882; 96.7177 | 457.45 | Jarzembska, Katarzyna N.; Kamiński, Radosław; Dobrzycki, Lukasz; Cyrański, Michał K First experimental charge density study using a Bruker CMOS-type PHOTON 100 detector: the case of ammonium tetraoxalate dihydrate. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 847-855 |
| 2311665 | CIF Paper | C1.29 H7.59 Au Cl4 O2 | P -1 | 8.0454; 8.0457; 10.291 94.31; 104.08; 109.21 | 601.3 | Kubus, Mariusz; Ströbele, Markus; Meyer, H Jürgen Structure of a new chloroauric acid. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2014, 70, 897-899 |
| 2311666 | CIF | C14 H15 N4 O4 P | P -1 | 9.2849; 10.835; 15.295 89.96; 84.78; 80.54 | 1511.3 | Gholivand, Khodayar; Molaei, Foroogh; Hosseini, Mahdieh Phosphoramides bearing isoxazole derivative: spectroscopic and structural characterization, study of hydrogen-bonding interactions and two lanthanide complexes (LnIII = Ce and Eu). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 176-185 |
| 2311667 | CIF Paper | C36 H42 Ce N7 O15 P2 | P 1 21/n 1 | 14.8817; 15.9332; 36.7289 90; 96.133; 90 | 8659.1 | Gholivand, Khodayar; Molaei, Foroogh; Hosseini, Mahdieh Phosphoramides bearing isoxazole derivative: spectroscopic and structural characterization, study of hydrogen-bonding interactions and two lanthanide complexes (LnIII = Ce and Eu). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 176-185 |
| 2311668 | CIF | C36 H42 Eu N7 O15 P2 | P 1 21/n 1 | 14.8395; 15.8178; 36.7471 90; 96.168; 90 | 8575.6 | Gholivand, Khodayar; Molaei, Foroogh; Hosseini, Mahdieh Phosphoramides bearing isoxazole derivative: spectroscopic and structural characterization, study of hydrogen-bonding interactions and two lanthanide complexes (LnIII = Ce and Eu). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 176-185 |
| 2311669 | CIF Paper | C46 H54 Co N2 O4 P2 S4 | P 1 21/n 1 | 10.254; 15.557; 15.444 90; 102.287; 90 | 2407.2 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural elucidation of new complexes of 2,4- and 3,5-dimethyl diphenyldithiophosphates with cobalt(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 221-227 |
| 2311670 | CIF | C42 H46 Co N2 O4 P2 S4 | P 1 21/n 1 | 11.8107; 14.4211; 12.8807 90; 104.929; 90 | 2119.8 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural elucidation of new complexes of 2,4- and 3,5-dimethyl diphenyldithiophosphates with cobalt(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 221-227 |
| 2311671 | CIF | C46 H54 Co N2 O4 P2 S4 | P 1 21/c 1 | 8.0404; 16.3777; 18.9182 90; 98.074; 90 | 2466.5 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural elucidation of new complexes of 2,4- and 3,5-dimethyl diphenyldithiophosphates with cobalt(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 221-227 |
| 2311672 | CIF | C46 H54 Co N2 O4 P2 S4 | P -1 | 9.5631; 9.8309; 14.2326 99.29; 98.602; 112.994 | 1181.83 | Kumar, Sandeep; Khajuria, Ruchi; Jassal, Amanpreet Kaur; Hundal, Maninder S.; Pandey, Sushil K. Synthesis and structural elucidation of new complexes of 2,4- and 3,5-dimethyl diphenyldithiophosphates with cobalt(II). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 221-227 |
| 2311673 | CIF Paper | C18 H22 N4 O7 | P -1 | 10.47; 14.6637; 15.0285 61.535; 83.55; 71.02 | 1915.6 | Tilborg, Anaelle; Carletta, Andrea; Wouters, Johan Structural and energy insights on solid-state complexes with trimethoprim: a combined theoretical and experimental investigation. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 406-415 |
| 2311674 | CIF Paper | C19 H15 N3 O2 | C 1 c 1 | 10.3885; 16.7902; 8.9064 90; 97.704; 90 | 1539.48 | Souza, Talita Evelyn; Rosa, Iara Maria Landre; Legendre, Alexandre Oliveira; Paschoal, Diego; Maia, Lauro J. Q.; Dos Santos, Hélio F; Matins, Felipe Terra; Doriguetto, Antonio Carlos Non-centrosymmetric crystals of new N-benzylideneaniline derivatives as potential materials for non-linear optics. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 416-426 |
| 2311675 | CIF Paper | C19 H14 N4 O4 | P 21 21 21 | 6.5715; 15.0533; 17.0598 90; 90; 90 | 1687.6 | Souza, Talita Evelyn; Rosa, Iara Maria Landre; Legendre, Alexandre Oliveira; Paschoal, Diego; Maia, Lauro J. Q.; Dos Santos, Hélio F; Matins, Felipe Terra; Doriguetto, Antonio Carlos Non-centrosymmetric crystals of new N-benzylideneaniline derivatives as potential materials for non-linear optics. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 416-426 |
| 2311676 | CIF Paper | C17 H19 N3 O2 | P 1 21/c 1 | 16.1019; 7.6028; 12.3616 90; 91.615; 90 | 1512.7 | Souza, Talita Evelyn; Rosa, Iara Maria Landre; Legendre, Alexandre Oliveira; Paschoal, Diego; Maia, Lauro J. Q.; Dos Santos, Hélio F; Matins, Felipe Terra; Doriguetto, Antonio Carlos Non-centrosymmetric crystals of new N-benzylideneaniline derivatives as potential materials for non-linear optics. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 416-426 |
| 2311677 | CIF Paper | C11 H13 Cl N2 O2 | P c a b | 5.183; 16.808; 27.247 90; 90; 90 | 2373.6 | Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454 |
| 2311678 | CIF | C11 H9 Br N2 O | P b c a | 10.1389; 7.5691; 27.0498 90; 90; 90 | 2075.9 | Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454 |
| 2311679 | CIF | C11 H12 Br Cl N2 O2 | P -1 | 6.845; 7.141; 13.905 101.723; 95.164; 100.511 | 648.6 | Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454 |
| 2311680 | CIF | C11 H15 N3 O6 | P -1 | 7.0408; 8.4596; 11.4455 89.438; 86.904; 82.072 | 674.22 | Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454 |
| 2311681 | CIF | C11 H12 Cl N3 O3 | P 1 21/c 1 | 21.91; 8.0131; 14.3802 90; 97.325; 90 | 2504.08 | Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454 |
| 2311682 | CIF Paper | C25 H27 F2 N3 O8 | P -1 | 8.6341; 10.5326; 14.302 89.016; 73.535; 82.924 | 1237.6 | Zhang, Zhi-Hui; Zhang, Qi; Zhang, Qing-Qing; Chen, Chen; He, Ming-Yang; Chen, Qun; Song, Guo-Qiang; Xuan, Xiao-Peng; Huang, Xian-Feng From a binary salt to salt co-crystals of antibacterial agent lomefloxacin with improved solubility and bioavailability. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 437-446 |
| 2311683 | CIF | C25 H28 F2 N7 O10 | P -1 | 9.551; 9.701; 15.45 83.87; 73.816; 83.271 | 1361.2 | Zhang, Zhi-Hui; Zhang, Qi; Zhang, Qing-Qing; Chen, Chen; He, Ming-Yang; Chen, Qun; Song, Guo-Qiang; Xuan, Xiao-Peng; Huang, Xian-Feng From a binary salt to salt co-crystals of antibacterial agent lomefloxacin with improved solubility and bioavailability. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 437-446 |
| 2311684 | CIF | C30 H35 F2 N5 O12 | P -1 | 10.032; 12.123; 14.336 86.396; 71.375; 74.221 | 1589.4 | Zhang, Zhi-Hui; Zhang, Qi; Zhang, Qing-Qing; Chen, Chen; He, Ming-Yang; Chen, Qun; Song, Guo-Qiang; Xuan, Xiao-Peng; Huang, Xian-Feng From a binary salt to salt co-crystals of antibacterial agent lomefloxacin with improved solubility and bioavailability. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 437-446 |
| 2311685 | CIF Paper | C20 H22 Cl2 Cu2 N8 O2 | P -1 | 8.251; 8.949; 9.596 64.89; 78.49; 66.231 | 586.8 | Vologzhanina, Anna V.; Kats, Svitlana V.; Penkova, Larisa V.; Pavlenko, Vadim A.; Efimov, Nikolay N.; Minin, Vadim V.; Eremenko, Igor L. Combined analysis of chemical bonding in a Cu(II) dimer using QTAIM, Voronoi tessellation and Hirshfeld surface approaches. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 543-554 |
| 2311686 | CIF Paper | C5 H11 N O2 | P 1 21 1 | 9.6697; 5.2749; 12.063 90; 90.803; 90 | 615.23 | Rychkov, Denis; Arkhipov, Sergey; Boldyreva, Elena Structure-forming units of amino acid maleates. Case study of L-valinium hydrogen maleate. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 160-163 |
| 2311687 | CIF Paper | C9 H15 N O6 | P 1 21 1 | 5.7793; 7.5974; 12.9136 90; 93.13; 90 | 566.16 | Rychkov, Denis; Arkhipov, Sergey; Boldyreva, Elena Structure-forming units of amino acid maleates. Case study of L-valinium hydrogen maleate. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 160-163 |
| 2311688 | CIF Paper | C4 H4 O4 | P 1 21/c 1 | 7.1511; 10.1107; 7.6405 90; 119.405; 90 | 481.26 | Rychkov, Denis; Arkhipov, Sergey; Boldyreva, Elena Structure-forming units of amino acid maleates. Case study of L-valinium hydrogen maleate. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 160-163 |
| 2311689 | CIF Paper | Mo O3 | P m c n | 3.6961; 3.96122; 13.85331 90; 90; 90 | 202.827 | Sławiński, Wojciech A; Fjellvåg, Øystein S; Ruud, Amund; Fjellvåg, Helmer A novel polytype - the stacking fault based γ-MoO3 nanobelts. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 201-208 |
| 2311690 | CIF | C8 H15 N O3 | P b c a | 7.0603; 9.2687; 29.062 90; 90; 90 | 1901.8 | Yajima, Tatsuo; Kimura, Makiko; Hori, Yoshihiro; Shiraiwa, Tadashi Structures of N-acetyl-DL-isoleucine, N-acetyl-DL-alloisoleucine and their ammonium salts; role of ammonium ions in crystal structure formation. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 650-657 |
| 2311691 | CIF | C8 H15 N O3 | P b c a | 11.6067; 12.8312; 13.3226 90; 90; 90 | 1984.11 | Yajima, Tatsuo; Kimura, Makiko; Hori, Yoshihiro; Shiraiwa, Tadashi Structures of N-acetyl-DL-isoleucine, N-acetyl-DL-alloisoleucine and their ammonium salts; role of ammonium ions in crystal structure formation. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 650-657 |
| 2311692 | CIF | C8 H18 N2 O3 | P 1 21/n 1 | 7.907; 5.843; 23.633 90; 96.126; 90 | 1085.6 | Yajima, Tatsuo; Kimura, Makiko; Hori, Yoshihiro; Shiraiwa, Tadashi Structures of N-acetyl-DL-isoleucine, N-acetyl-DL-alloisoleucine and their ammonium salts; role of ammonium ions in crystal structure formation. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 650-657 |
| 2311693 | CIF | C8 H18 N2 O3 | P n a 21 | 24.376; 7.5507; 5.8064 90; 90; 90 | 1068.7 | Yajima, Tatsuo; Kimura, Makiko; Hori, Yoshihiro; Shiraiwa, Tadashi Structures of N-acetyl-DL-isoleucine, N-acetyl-DL-alloisoleucine and their ammonium salts; role of ammonium ions in crystal structure formation. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 650-657 |
| 2311694 | CIF Paper | C20 H24 | R -3 :H | 15.9791; 15.9791; 5.58227 90; 90; 120 | 1234.37 | Solovyov, Leonid A. Accurate unrestrained DDM refinement of crystal structures from highly distorted and low-resolution powder diffraction data. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 738-743 |
| 2311695 | CIF Paper | C18 H20 N4 O8 | P -1 | 3.81737; 9.60821; 13.36297 94.2993; 91.7434; 91.7142 | 488.268 | Solovyov, Leonid A. Accurate unrestrained DDM refinement of crystal structures from highly distorted and low-resolution powder diffraction data. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2016, 72, 738-743 |
| 2311696 | CIF Paper | C38 H24 I2 N4 | P -1 | 9.7245; 10.1191; 17.5288 87.839; 80.433; 70.331 | 1601.35 | Wijethunga, Tharanga K.; Đaković, Marijana; Desper, John; Aakeröy, Christer B A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 163-167 |
| 2311697 | CIF | C38 H24 I2 N8 | C 1 2/c 1 | 16.0411; 22.6435; 9.6728 90; 102.322; 90 | 3432.5 | Wijethunga, Tharanga K.; Đaković, Marijana; Desper, John; Aakeröy, Christer B A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 163-167 |
| 2311698 | CIF Paper | C38 H24 I2 N4 O2 | P -1 | 9.6027; 10.0523; 18.021 85.6; 80.043; 68.603 | 1595.1 | Wijethunga, Tharanga K.; Đaković, Marijana; Desper, John; Aakeröy, Christer B A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 163-167 |
| 2311699 | CIF | C30 H20 I2 N2 | P -1 | 9.5153; 9.6261; 14.368 96.346; 93.215; 103.295 | 1268.4 | Wijethunga, Tharanga K.; Đaković, Marijana; Desper, John; Aakeröy, Christer B A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 163-167 |
| 2311700 | CIF | C30 H18 I2 N2 | P 1 21/c 1 | 14.4231; 13.6011; 13.4798 90; 109.397; 90 | 2494.2 | Wijethunga, Tharanga K.; Đaković, Marijana; Desper, John; Aakeröy, Christer B A new tecton with parallel halogen-bond donors: a path to supramolecular rectangles. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 163-167 |
| 2311701 | CIF Paper | C20 H12 Cl2 S2 | P c a 21 | 7.824; 28.782; 14.35 90; 90; 90 | 3231.5 | Tsubomoto, Yutaka; Hayashi, Satoko; Nakanishi, Waro; Sasamori, Takahiro; Tokitoh, Norihiro Nature of E<sub>2</sub>X<sub>2</sub> σ(4c-6e) of the X—E-E—X type at naphthalene 1,8-positions and model, elucidated by X-ray crystallographic analysis and QC calculations with the QTAIM approach. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 265-275 |
| 2311702 | CIF | C20 H12 Cl2 Se2 | P c a 21 | 7.8933; 29.1713; 14.4594 90; 90; 90 | 3329.39 | Tsubomoto, Yutaka; Hayashi, Satoko; Nakanishi, Waro; Sasamori, Takahiro; Tokitoh, Norihiro Nature of E<sub>2</sub>X<sub>2</sub> σ(4c-6e) of the X—E-E—X type at naphthalene 1,8-positions and model, elucidated by X-ray crystallographic analysis and QC calculations with the QTAIM approach. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 265-275 |
| 2311703 | CIF | C20 H12 Br2 Se2 | P -1 | 7.8394; 8.0986; 15.065 90.941; 101.888; 111.093 | 868.92 | Tsubomoto, Yutaka; Hayashi, Satoko; Nakanishi, Waro; Sasamori, Takahiro; Tokitoh, Norihiro Nature of E<sub>2</sub>X<sub>2</sub> σ(4c-6e) of the X—E-E—X type at naphthalene 1,8-positions and model, elucidated by X-ray crystallographic analysis and QC calculations with the QTAIM approach. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 265-275 |
| 2311704 | CIF Paper | Li Nb O3 | R 3 c :H | 5.146; 5.146; 13.859 90; 90; 120 | 317.84 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311705 | CIF | Li Nb0.7 O3 Ta0.3 | R 3 c :H | 5.145; 5.145; 13.841 90; 90; 120 | 317.3 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311706 | CIF | Li Nb0.47 O3 Ta0.53 | R 3 c :H | 5.147; 5.147; 13.834 90; 90; 120 | 317.39 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311707 | CIF | Li Nb0.4 O3 Ta0.6 | R 3 c :H | 5.147; 5.147; 13.798 90; 90; 120 | 316.56 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311708 | CIF | Li Nb0.36 O3 Ta0.64 | R 3 c :H | 5.149; 5.149; 13.786 90; 90; 120 | 316.53 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311709 | CIF | Li Nb0.11 O3 Ta0.89 | R 3 c :H | 5.151; 5.151; 13.776 90; 90; 120 | 316.55 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311710 | CIF | Li Nb0.08 O3 Ta0.92 | R 3 c :H | 5.149; 5.149; 13.781 90; 90; 120 | 316.42 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311711 | CIF | Li O3 Ta | R 3 c :H | 5.148; 5.148; 13.767 90; 90; 120 | 315.97 | Huband, S.; Keeble, D. S.; Zhang, N.; Glazer, A. M.; Bartasyte, A.; Thomas, P. A. Crystallographic and optical study of LiNb<sub>1 - x</sub>Ta<sub>x</sub>O<sub>3</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 498-506 |
| 2311712 | CIF Paper | C20 H19 F N8 O2 | P -1 | 8.0917; 10.8937; 11.7949 88.338; 82.344; 78.787 | 1010.76 | Zhou, Xinbo; Hu, Xiurong; Gu, Jianming; Zhu, Jianrong Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 891-898 |
| 2311713 | CIF Paper | C22 H22 F N9 O2 | P -1 | 8.4657; 11.4408; 13.1812 112.419; 90.914; 93.446 | 1176.99 | Zhou, Xinbo; Hu, Xiurong; Gu, Jianming; Zhu, Jianrong Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 891-898 |
| 2311714 | CIF Paper | C21.5 H22.5 F N8.5 O2.5 | P -1 | 10.6703; 13.422; 16.9095 73.92; 74.788; 83.294 | 2242.9 | Zhou, Xinbo; Hu, Xiurong; Gu, Jianming; Zhu, Jianrong Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 891-898 |
| 2311715 | CIF Paper | C20 H19 F N8 O2 | P -1 | 13.1749; 13.7062; 14.4719 70.217; 72.912; 70.776 | 2272.5 | Zhou, Xinbo; Hu, Xiurong; Gu, Jianming; Zhu, Jianrong Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 891-898 |
| 2311716 | CIF Paper | Cu3.313 Si | P -3 1 c | 16.2448; 16.2448; 44.017 90; 90; 120 | 10059.6 | Corrêa, Cinthia Antunes; Perez, Olivier; Kopeček, Jaromír; Brázda, Petr; Klementová, Mariana; Palatinus, Lukáš Crystal structures of η''-Cu<sub>3+x</sub>Si and η'''-Cu<sub>3+x</sub>Si. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 767-774 |
| 2311717 | CIF Paper | Cu3.311 Si | P -3 | 56.98; 56.98; 44.055 90; 90; 120 | 123871 | Corrêa, Cinthia Antunes; Perez, Olivier; Kopeček, Jaromír; Brázda, Petr; Klementová, Mariana; Palatinus, Lukáš Crystal structures of η''-Cu<sub>3+x</sub>Si and η'''-Cu<sub>3+x</sub>Si. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 767-774 |
| 2311718 | CIF | C4 H12 Cl4 Fe N | P b m a | 13.1442; 13.9946; 6.4272 90; 90; 90 | 1182.27 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311719 | CIF | C4 H12 Cl4 Fe N | P b m a | 13.1361; 14.0158; 6.4831 90; 90; 90 | 1193.62 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311720 | CIF | C4 H12 Cl4 Fe N | P b m 2 | 6.4471; 14.2753; 6.4526 90; 90; 90 | 593.86 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311721 | CIF | C4 H12 Cl4 Fe N | P 1 m 1 | 6.425; 7.148; 6.4274 90; 91.21; 90 | 295.12 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311722 | CIF | C4 H12 Cl4 Fe N | P 1 21/m 1 | 6.574; 14.156; 6.595 90; 93.87; 90 | 612.3 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311723 | CIF | C4 Cl4 Fe N | P m -3 m | 6.847; 6.847; 6.847 90; 90; 90 | 321 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311724 | CIF | C4 H12 Cl4 Ga N | P c m b | 6.282; 14.0388; 12.8067 90; 90; 90 | 1129.45 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311725 | CIF | C4 H12 Cl4 Ga N | P b m a | 12.8303; 14.0961; 6.3359 90; 90; 90 | 1145.89 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311726 | CIF | C4 H12 Cl4 Ga N | P b m a | 12.8329; 14.1248; 6.3718 90; 90; 90 | 1154.97 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311727 | CIF | C4 H12 Cl4 Ga N | P b m a | 12.8736; 14.1743; 6.4043 90; 90; 90 | 1168.62 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311728 | CIF | C4 H12 Cl4 Ga N | P 1 m 1 | 6.4571; 7.1456; 6.4596 90; 91.721; 90 | 297.91 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311729 | CIF | C4 Cl4 Ga N | P m -3 m | 6.8504; 6.8504; 6.8504 90; 90; 90 | 321.48 | Binns, Jack; McIntyre, Garry J.; Barreda-Argüeso, José A; González, Jesús; Aguado, Fernando; Rodríguez, Fernando; Valiente, Rafael; Parsons, Simon Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 844-855 |
| 2311730 | CIF | Be2 Ca0.55 Ce0.2 Fe0.57 O10 Si2 Y1.25 | P 1 21/c 1 | 4.7514; 7.5719; 9.9414 90; 90.015; 90 | 357.66 | Chukanov, Nikita V.; Aksenov, Sergey M.; Rastsvetaeva, Ramiza K.; Kristiansen, Roy; Pekov, Igor V.; Belakovskiy, Dmitriy I.; Van, Konstantin V.; Bychkova, Yana V.; Britvin, Sergey N. Crystal structure of the OH-dominant gadolinite-(Y) analogue (Y,Ca)<sub>2</sub>(Fe,\σquare )Be<sub>2</sub>Si<sub>2</sub>O<sub>8</sub>(OH,O)<sub>2</sub> from Heftetjern pegmatite, Norway. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 899-906 |
| 2311731 | CIF Paper | C14 H11 F3 N2 | P -1 | 9.6399; 10.3142; 13.4202 99.961; 107.306; 97.321 | 1231.8 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311732 | CIF | C15 H10 F6 N2 | C 1 c 1 | 15.2831; 4.8177; 19.0386 90; 103.74; 90 | 1361.69 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311733 | CIF | C15 H10 F6 N2 | P -1 | 8.189; 8.376; 11.623 72.723; 82.222; 62.417 | 674.7 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311734 | CIF | C14 H11 F3 N2 | P n a 21 | 11.5823; 13.8757; 7.4479 90; 90; 90 | 1196.97 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311735 | CIF | C15 H10 F6 N2 | P -1 | 8.2523; 8.3039; 11.793 82.823; 74.769; 61.428 | 684.78 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311736 | CIF | C15 H10 F6 N2 | C 1 2/c 1 | 14.33; 13.658; 7.938 90; 112.607; 90 | 1434.2 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311737 | CIF | C15 H10 F6 N2 | P n a 21 | 11.2082; 16.2891; 15.2689 90; 90; 90 | 2787.67 | Dey, Dhananjay; Chopra, Deepak Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 781-793 |
| 2311738 | CIF | Fe H5 O7 S | P n m a | 20.0789; 7.4024; 7.2294 90; 90; 90 | 1074.5 | Plášil, Jakub; Petříček, Václav; Majzlan, Juraj A commensurately modulated structure of parabutlerite, Fe<sup>III</sup>SO<sub>4</sub>(OH)·2H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 856-862 |
| 2311739 | CIF | Ba0.476 Nb2 O6 Sr0.524 | P 4 b m (a,b,2*c) | 12.4693; 12.4693; 7.9006 90; 90; 90 | 1228.41 | Graetsch, Heribert A. Structural changes of relaxor ferroelectric Sr<sub>0.52</sub>Ba<sub>0.48</sub>Nb<sub>2</sub>O<sub>6</sub> (SBN52) on quenching and reheating. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 820-826 |
| 2311740 | CIF | Ba0.47 Nb2 O6 Sr0.53 | P 4 b m (a,b,2*c) | 12.4629; 12.4629; 7.9032 90; 90; 90 | 1227.56 | Graetsch, Heribert A. Structural changes of relaxor ferroelectric Sr<sub>0.52</sub>Ba<sub>0.48</sub>Nb<sub>2</sub>O<sub>6</sub> (SBN52) on quenching and reheating. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 820-826 |
| 2311741 | CIF | H K2.91 N0.09 O8 S2 | C 1 2/c 1 | 14.692; 5.681; 9.776 90; 102.99; 90 | 795.1 | Choudhury, R. R.; Chitra, R.; Selezneva, E. V.; Makarova, I. P. Effect of cationic substitution on the double-well hydrogen-bond potential in [K<sub>1-x</sub>(NH<sub>4</sub>)<sub>x</sub>]<sub>3</sub>H(SO<sub>4</sub>)<sub>2</sub> proton conductors: a single-crystal neutron diffraction study. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 863-867 |
| 2311742 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0083; 5.0083; 33.3987 90; 90; 120 | 725.51 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311743 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0084; 5.0084; 33.3941 90; 90; 120 | 725.43 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311744 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0113; 5.0113; 33.5158 90; 90; 120 | 728.92 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311745 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0135; 5.0135; 33.4784 90; 90; 120 | 728.75 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311746 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0161; 5.0161; 33.4952 90; 90; 120 | 729.87 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311747 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.016; 5.016; 33.517 90; 90; 120 | 730.32 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311748 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.018; 5.018; 33.5012 90; 90; 120 | 730.55 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311749 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0183; 5.0183; 33.5074 90; 90; 120 | 730.78 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311750 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0187; 5.0187; 33.5273 90; 90; 120 | 731.33 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311751 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0198; 5.0198; 33.5169 90; 90; 120 | 731.42 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311752 | CIF | C6 Ba3 Mg3 O18 | R -3 c :H | 5.0206; 5.0206; 33.5307 90; 90; 120 | 731.96 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311753 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0209; 5.0209; 16.7515 90; 90; 120 | 365.719 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311754 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0214; 5.0214; 16.7931 90; 90; 120 | 366.7 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311755 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0206; 5.0206; 16.7875 90; 90; 120 | 366.46 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311756 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0217; 5.0217; 16.8037 90; 90; 120 | 366.98 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311757 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0224; 5.0224; 16.8222 90; 90; 120 | 367.48 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311758 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0228; 5.0228; 16.862 90; 90; 120 | 368.41 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311759 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0256; 5.0256; 16.782 90; 90; 120 | 367.07 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311760 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.027; 5.027; 16.778 90; 90; 120 | 367.19 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311761 | CIF | C6 Ba3 Mg3 O18 | R -3 m :H | 5.0277; 5.0277; 16.7972 90; 90; 120 | 367.71 | Ende, Martin; Effenberger, Herta; Miletich, Ronald Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 827-835 |
| 2311762 | CIF | C4 H10 B F4 N O | P n a m | 8.09423; 9.40452; 9.54481 90; 90; 90 | 726.57 | Noohinejad, Leila; van Smaalen, Sander; Petříček, Václav; Schönleber, Andreas Incommensurately modulated structure of morpholinium tetrafluoroborate and configurational versus chemical entropies at the incommensurate and lock-in phase transitions. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 836-843 |
| 2311763 | CIF | C4 H10 B F4 N O | P n a m | 8.131; 9.40719; 9.58445 90; 90; 90 | 733.11 | Noohinejad, Leila; van Smaalen, Sander; Petříček, Václav; Schönleber, Andreas Incommensurately modulated structure of morpholinium tetrafluoroborate and configurational versus chemical entropies at the incommensurate and lock-in phase transitions. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 836-843 |
| 2311764 | CIF Paper | C20 H24 N4 O4 | P 1 n 1 | 6.0925; 26.145; 12.1017 90; 99.3633; 90 | 1902 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311765 | CIF | C20 H24 N4 O4 | P 1 n 1 | 6.1262; 26.531; 12.0982 90; 99.5055; 90 | 1939.4 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311766 | CIF | C20 H24 N4 O4 | P 1 n 1 | 6.1343; 26.629; 12.0933 90; 99.514; 90 | 1948.3 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311767 | CIF | C20 H24 N4 O4 | P 1 n 1 | 6.1398; 26.721; 12.0772 90; 99.554; 90 | 1953.9 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311768 | CIF | C20 H24 N4 O4 | P 1 n 1 | 6.1457; 26.765; 12.0716 90; 99.654; 90 | 1957.5 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311769 | CIF | C20 H24 N4 O4 | F m m 2 | 10.1183; 27.015; 7.1684 90; 90; 90 | 1959.5 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311770 | CIF | C20 H24 N4 O4 | F m m 2 | 10.1464; 27.166; 7.1898 90; 90; 90 | 1981.8 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311771 | CIF | C20 H24 N4 O4 | F m m 2 | 10.1732; 27.291; 7.2049 90; 90; 90 | 2000.3 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311772 | CIF | C22 H28 N4 O4 | P 1 21/n 1 | 6.1425; 28.085; 12.1822 90; 99.6957; 90 | 2071.6 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311773 | CIF | C22 H28 N4 O4 | P 1 21/n 1 | 6.202; 28.482; 12.225 90; 100.276; 90 | 2124.9 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311774 | CIF | C22 H28 N4 O4 | C m c m | 10.1948; 7.3566; 28.679 90; 90; 90 | 2150.9 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311775 | CIF | C22 H28 N4 O4 | C m c m | 10.1958; 7.3592; 28.718 90; 90; 90 | 2154.8 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 879-890 |
| 2311776 | CIF Paper | Ba2 La2 O13 Si4 | P -1 | 6.7327; 8.9894; 10.2191 86.6588; 73.566; 86.5873 | 591.62 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311777 | CIF | Ba2 Ce2 O13 Si4 | P -1 | 6.7062; 8.9719; 10.1565 86.6118; 73.5658; 86.4609 | 584.45 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311778 | CIF | Ba2 O13 Pr2 Si4 | P -1 | 6.688; 8.953; 10.1324 86.5023; 73.5481; 86.2929 | 580.07 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311779 | CIF | Ba2 O13 Si4 Sm2 | C 1 2/c 1 | 12.9961; 5.2355; 17.626 90; 104.148; 90 | 1162.9 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311780 | CIF | Ba2 Eu2 O13 Si4 | C 1 2/c 1 | 12.9545; 5.2311; 17.595 90; 104.23; 90 | 1155.8 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311781 | CIF | Ba2 O13 Si4 Tb2 | C 1 2/c 1 | 12.8568; 5.2019; 17.5243 90; 104.147; 90 | 1136.48 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311782 | CIF | Ba2 Dy2 O13 Si4 | C 1 2/c 1 | 12.8478; 5.202; 17.525 90; 104.077; 90 | 1136.1 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311783 | CIF | Ba2 Ho2 O13 Si4 | C 1 2/c 1 | 12.8127; 5.1934; 17.514 90; 103.971; 90 | 1130.9 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311784 | CIF | Ba2 Er2 F2 O12 Si4 | P -1 | 5.476; 7.166; 8.958 108.138; 102.03; 92.742 | 324.3 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311785 | CIF | Ba2 F2 O12 Si4 Tm2 | P -1 | 5.4609; 7.1258; 8.9379 107.809; 101.987; 92.866 | 321.5 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311786 | CIF | Ba2 F2 O12 Si4 Yb2 | P -1 | 5.4461; 7.1212; 8.9128 107.798; 101.866; 92.9455 | 319.66 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311787 | CIF | Ba2 F2 Lu2 O12 Si4 | P -1 | 5.451; 7.1227; 8.8937 107.73; 101.81; 93.01 | 319.5 | Fulle, Kyle; Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W. Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>). Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 907-915 |
| 2311788 | CIF | F18 K36 O108 Sc18 Si36 | P 1 2/m 1 | 26.785; 8.2451; 26.824 90; 90; 90 | 5923.9 | Hejny, C.; Bindi, L. Low-temperature behaviour of K<sub>2</sub>Sc[Si<sub>2</sub>O<sub>6</sub>]F: determination of the lock-in phase and its relationships with fresnoite- and melilite-type compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 923-930 |
| 2311789 | CIF | S28 Sn12 | P 63/m m c | 13.2748; 13.2748; 19.1521 90; 90; 120 | 2922.83 | Filsø, Mette Ø; Chaaban, Iman; Al Shehabi, Amer; Skibsted, Jørgen; Lock, Nina The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 931-940 |
| 2311790 | CIF | C14 H26 N4 S7 Sn3 | P 21 21 2 | 13.2299; 22.2673; 9.0772 90; 90; 90 | 2674.09 | Filsø, Mette Ø; Chaaban, Iman; Al Shehabi, Amer; Skibsted, Jørgen; Lock, Nina The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 931-940 |
| 2311791 | CIF | C14 H26 N4 S7 Sn3 | P 21 21 2 | 13.1724; 22.2035; 8.9383 90; 90; 90 | 2614.2 | Filsø, Mette Ø; Chaaban, Iman; Al Shehabi, Amer; Skibsted, Jørgen; Lock, Nina The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 931-940 |
| 2311792 | CIF | Al3 Cu6 O30 S Sb | P -1 | 7.766; 8.759; 11.306 108.67; 83.41; 126.64 | 581.7 | Mills, Stuart J.; Christy, Andrew G.; Favreau, Georges; Galea-Clolus, Valérie Multidimensional structural variation in the cyanotrichite family of merotypes: camerolaite-3b-Fβar 1. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 950-955 |
| 2311793 | CIF | C10 H11 Cl2 Hg N O2 | P 1 21/c 1 | 7.0762; 25.964; 7.445 90; 118.506; 90 | 1202 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311794 | CIF | C20 H22 Cl2 Hg N2 O4 | C 1 2/c 1 | 26.0002; 6.4821; 16.196 90; 127.176; 90 | 2174.9 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311795 | CIF | C10 H11 Br2 Hg N O2 | P b c a | 6.8597; 13.9425; 26.7054 90; 90; 90 | 2554.1 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311796 | CIF | C20 H22 Br2 Hg N2 O4 | C 1 2/c 1 | 26.6909; 6.5248; 16.07 90; 126.946; 90 | 2236.7 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311797 | CIF | C10 H11 Hg I2 N O2 | P b c a | 7.0546; 14.2685; 27.4248 90; 90; 90 | 2760.5 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311798 | CIF | C84 H80 Al2 Br8 Cl4 Hg4 N6 O17 | P 1 21/c 1 | 16.7982; 24.3995; 13.9346 90; 107.435; 90 | 5448.9 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311799 | CIF | C69 H86 Al2 Cl2 Hg3 I6 N6 O23.18 | C 1 2/c 1 | 32.1651; 13.8294; 27.6145 90; 124.917; 90 | 10072.3 | Truong, Khai Nghi; Merkens, Carina; Englert, Ulli 3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 981-991 |
| 2311800 | CIF | C12 H11 N3 O5 | P 1 21/c 1 | 7.7759; 6.7421; 23.996 90; 95.224; 90 | 1252.8 | Sarmah, Kashyap Kumar; Rajbongshi, Trishna; Bhowmick, Sourav; Thakuria, Ranjit First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 1007-1016 |
| 2311801 | CIF | C12 H11 N3 O5 | P 1 21/c 1 | 10.0839; 5.0936; 23.335 90; 99.605; 90 | 1181.8 | Sarmah, Kashyap Kumar; Rajbongshi, Trishna; Bhowmick, Sourav; Thakuria, Ranjit First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 1007-1016 |
| 2311802 | CIF | C12 H11 N3 O5 | P 1 21/c 1 | 5.0262; 25.2701; 9.7106 90; 97.492; 90 | 1222.84 | Sarmah, Kashyap Kumar; Rajbongshi, Trishna; Bhowmick, Sourav; Thakuria, Ranjit First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 1007-1016 |
| 2311803 | CIF | C15 H15 N3 O5 | P -1 | 7.4159; 10.169; 11.0335 70.471; 76.142; 78.253 | 754.4 | Sarmah, Kashyap Kumar; Rajbongshi, Trishna; Bhowmick, Sourav; Thakuria, Ranjit First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 1007-1016 |
| 2311804 | CIF | C12 H13 N3 O4 S | P -1 | 7.6458; 9.9985; 18.027 103.727; 92.711; 91.656 | 1336.1 | Sarmah, Kashyap Kumar; Rajbongshi, Trishna; Bhowmick, Sourav; Thakuria, Ranjit First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 1007-1016 |
| 2311805 | CIF | C14 H26 N2 O9 | P 1 21/n 1 | 17.283; 5.7371; 18.561 90; 108.274; 90 | 1747.6 | Mora, Asiloé J; Belandria, Lusbely M.; Delgado, Gerzon E.; Seijas, Luis E.; Lunar, Angel; Almeida, Rafael Non-covalent interactions in the multicomponent crystal of 1-aminocyclopentane carboxylic acid, oxalic acid and water: a crystallographic and a theoretical approach. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017, 73, 968-980 |
| 2312041 | CIF HKL Paper | C18 H18 Ba O16 | P 1 21/n 1 | 7.0784; 13.3979; 22.009 90; 98.359; 90 | 2065.07 | Safari, Manije; Sedghiniya, Sima; Soleimannejad, Janet; Janczak, Jan Efficient modulation of a barium metal-organic framework using amino acids. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 114-121 |
| 2312042 | CIF HKL | C18 H18 Ba O16 | P 21 21 21 | 7.2781; 13.4581; 22.4129 90; 90; 90 | 2195.33 | Safari, Manije; Sedghiniya, Sima; Soleimannejad, Janet; Janczak, Jan Efficient modulation of a barium metal-organic framework using amino acids. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 114-121 |
| 2312082 | CIF HKL Paper | As4 Cl2 H10 N2 O7 | P 6/m m m | 5.2542; 5.2542; 12.6308 90; 90; 120 | 301.978 | Wrześniewska, Weronika; Paluch, Piotr; Guńka, Piotr A Arsenic(III) oxide intercalate with ammonium chloride: crystal structure revision and thermal characterization. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 207-212 |
| 2312108 | CIF HKL | C12 H13 N3 O2 S | F d d 2 | 46.689; 12.2502; 8.2435 90; 90; 90 | 4714.9 | Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Jaskolski, Mariusz; Gzella, Andrzej K. Proton tautomerism in 5-dimethylaminomethylidene-4-(o-,m-,p-hydroxyphenyl)amino-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 220-232 |
| 2312109 | CIF HKL | C15 H20 N4 O3 S | P 1 21/c 1 | 20.7594; 11.8833; 13.3407 90; 104.534; 90 | 3185.7 | Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Jaskolski, Mariusz; Gzella, Andrzej K. Proton tautomerism in 5-dimethylaminomethylidene-4-(o-,m-,p-hydroxyphenyl)amino-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 220-232 |
| 2312110 | CIF HKL | C15 H20 N4 O3 S | P 1 21/c 1 | 13.163; 17.0311; 7.3212 90; 99.213; 90 | 1620.1 | Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Jaskolski, Mariusz; Gzella, Andrzej K. Proton tautomerism in 5-dimethylaminomethylidene-4-(o-,m-,p-hydroxyphenyl)amino-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 220-232 |
| 2312118 | CIF HKL Paper | C18 H16 O Si | P 1 | 22.151; 24.498; 25.108 114.23; 101.09; 95.4 | 11963 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312119 | CIF HKL Paper | C18 H16 O Si | P 1 | 22.178; 24.504; 25.106 114.21; 101.16; 95.37 | 11978 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312120 | CIF HKL Paper | C18 H16 O Si | P -1 | 22.151; 24.498; 25.108 114.23; 101.09; 95.4 | 11963 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312121 | CIF HKL Paper | C18 H16 O Si | P -1 | 22.178; 24.504; 25.106 114.21; 101.16; 95.37 | 11978 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312122 | CIF HKL Paper | C18 H16 O Si | P -1 | 15.025; 19.506; 23.021 107.96; 102.68; 101.48 | 5997.5 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312123 | CIF HKL Paper | C18 H16 O Si | P 1 | 15.025; 19.506; 23.021 107.96; 102.68; 101.48 | 5997.5 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312124 | CIF HKL Paper | C18 H16 O Si | P -1 | 15.094; 19.62; 23.111 108.1; 102.99; 101.29 | 6073 | Krawczyk, Monika K. Unusual flash cooling-induced phase in a crystal of triphenylsilanol. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 245-251 |
| 2312137 | CIF HKL | Co Ga Mg | P 63/m m c | 5.0151; 5.0151; 8.1086 90; 90; 120 | 176.62 | Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Ciesielski, Wojciech; Rozdzynska-Kielbik, Beata; Indris, Sylvio; Ehrenberg, Helmut A new ternary derivative of the Laves phases in the Mg-Co-Ga system. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312138 | CIF HKL | Co Ga0.52 Mg0.74 | C m c m | 4.9868; 25.959; 8.0508 90; 90; 90 | 1042.2 | Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Ciesielski, Wojciech; Rozdzynska-Kielbik, Beata; Indris, Sylvio; Ehrenberg, Helmut A new ternary derivative of the Laves phases in the Mg-Co-Ga system. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312139 | CIF HKL | Co Ga0.15 Mg0.49 | R -3 m :H | 4.9296; 4.9296; 12.0744 90; 90; 120 | 254.11 | Pavlyuk, Nazar; Dmytriv, Grygoriy; Pavlyuk, Volodymyr; Ciesielski, Wojciech; Rozdzynska-Kielbik, Beata; Indris, Sylvio; Ehrenberg, Helmut A new ternary derivative of the Laves phases in the Mg-Co-Ga system. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312140 | CIF HKL Paper | Ag2.8 Cu0.2 Pb9.77 S28 Sb11.23 | P 1 21/n 1 | 8.1882; 27.2641; 22.8679 90; 90.283; 90 | 5105.1 | Stöger, Berthold; Göb, Christian; Topa, Dan A fresh view on the structure and twinning of owyheeite, a rod-polytype and twofold superstructure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312141 | CIF HKL Paper | C4 H4.36 Fe K2 O10.18 | P c a 21 | 12.0351; 15.1265; 10.5562 90; 90; 90 | 1921.75 | Amanchar, Sara; Schweitzer, Thierry; Mazet, Thomas; Malaman, Bernard; Diop, Leopold V. B.; Francois, Michel Structure of the new iron(II) oxalate potassium salt K<sub>2</sub>Fe[(C<sub>2</sub>O<sub>4</sub>)<sub>2</sub>(H<sub>2</sub>O)<sub>2</sub>]·0.18H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312142 | CIF HKL | C8 H14 Ni O12 | P -1 | 5.1335; 7.2734; 9.1031 107.952; 105.18; 92.139 | 309.472 | Pinto, Camila B.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. Experimental charge density and topological analysis of tetraaquabis(hydrogenmaleato)nickel(II): a comparison with Hirshfeld atom refinement. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312143 | CIF HKL | C0.1 H1.92 Al2.14 Ca2.48 K0.49 Mg0.04 Na0.21 O15.62 P0.2 S0.7 Si2.86 Sr0.06 | P 1 21 1 | 12.0206; 5.09502; 10.8527 90; 107.01; 90 | 635.6 | Zubkova, Natalia V.; Chukanov, Nikita V.; Varlamov, Dmitry A.; Vigasina, Marina F.; Pekov, Igor V.; Ksenofontov, Dmitry A.; Pushcharovsky, Dmitry Yu New data on the crystal chemistry of the natural two-layer aluminosilicates latiumite and tuscanite. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312144 | CIF HKL | C0.14 H4.04 Al4.2 Ca4.94 K0.9 Mg0.08 Na0.45 O31.4 P0.33 S1.53 Si5.8 Sr0.09 | P 1 21/a 1 | 23.9846; 5.09694; 10.8504 90; 107.032; 90 | 1268.26 | Zubkova, Natalia V.; Chukanov, Nikita V.; Varlamov, Dmitry A.; Vigasina, Marina F.; Pekov, Igor V.; Ksenofontov, Dmitry A.; Pushcharovsky, Dmitry Yu New data on the crystal chemistry of the natural two-layer aluminosilicates latiumite and tuscanite. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312151 | CIF HKL | C3 H16 Cl4 Mn N2 O2 | P -1 | 5.9138; 9.8318; 10.8908 73.154; 76.691; 87.551 | 589.58 | Abdel-Aal, Seham K; Souhassou, Mohamed; Durand, Pierrick; Lecomte, Claude; Abdel-Rahman, Ahmed S; Claiser, Nicolas Synthesis, crystal structure and phase transitions of novel hybrid perovskite: bis(1,2-diaminopropane) di-μ-chloro-bis[diaquadichloromanganate(II)] dichloride. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312152 | CIF HKL | Y Zn5.217 | P -3 1 c | 8.8811; 8.8811; 9.2057 90; 90; 120 | 628.812 | Fredrickson, Rie T.; Fredrickson, Daniel C. As predicted and more: modulated channel occupation in YZn<sub>5+x</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312165 | CIF HKL Paper | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3334; 14.6776; 18.2772 90; 90; 90 | 3308.62 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312166 | CIF HKL | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9662; 15.3404; 17.5869 90; 90; 90 | 3498.2 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312167 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3333; 12.4822; 17.2401 90; 115.745; 90 | 3359.77 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312168 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2809; 12.4718; 17.2385 90; 115.779; 90 | 3345.55 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312169 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3653; 12.3005; 16.9681 90; 115.771; 90 | 3263.92 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312170 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3421; 12.2466; 16.9062 90; 115.859; 90 | 3231.05 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312171 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3504; 12.2463; 16.9059 90; 115.859; 90 | 3232.44 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312172 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2304; 12.4328; 17.1722 90; 115.784; 90 | 3312.42 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312173 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3439; 12.3191; 16.992 90; 115.756; 90 | 3269.84 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312174 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3955; 12.2561; 16.9145 90; 115.834; 90 | 3245.8 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312175 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2586; 12.253; 16.9153 90; 115.851; 90 | 3219.12 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312176 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3888; 12.2512; 16.9092 90; 115.844; 90 | 3241.96 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312177 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2972; 12.4754; 17.2406 90; 115.77; 90 | 3350.34 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312178 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.1815; 12.2587; 16.9189 90; 115.825; 90 | 3207.62 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312179 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3163; 12.2478; 16.9086 90; 115.86; 90 | 3226.99 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312180 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3965; 12.2641; 16.9234 90; 115.816; 90 | 3250.29 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312181 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3581; 12.2465; 16.9054 90; 115.858; 90 | 3233.88 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312182 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3886; 12.2774; 16.9394 90; 115.797; 90 | 3255.95 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312183 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2381; 12.2553; 16.9184 90; 115.847; 90 | 3216.6 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312184 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3122; 12.3466; 17.0296 90; 115.747; 90 | 3278.65 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312185 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2746; 12.3794; 17.0784 90; 115.751; 90 | 3289.5 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312186 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2408; 12.4576; 17.221 90; 115.797; 90 | 3330.11 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312187 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3927; 12.2534; 16.9115 90; 115.838; 90 | 3243.85 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312188 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.1496; 12.2625; 16.9243 90; 115.814; 90 | 3203.98 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312189 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.1594; 12.2611; 16.9226 90; 115.815; 90 | 3205.08 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312190 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2011; 12.2556; 16.9151 90; 115.829; 90 | 3209.63 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312191 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.273; 12.47; 17.2369 90; 115.783; 90 | 3343.11 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312192 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2178; 12.2577; 16.921 90; 115.841; 90 | 3214.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312193 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3784; 12.2483; 16.9066 90; 115.852; 90 | 3238.54 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312194 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2891; 12.4738; 17.2395 90; 115.775; 90 | 3347.99 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312195 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3421; 12.4836; 17.2399 90; 115.74; 90 | 3361.97 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312196 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2974; 12.2491; 16.9106 90; 115.858; 90 | 3224.24 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312197 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2586; 12.4659; 17.2321 90; 115.79; 90 | 3338.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312198 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3059; 12.4774; 17.241 90; 115.765; 90 | 3352.78 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312199 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2485; 12.2541; 16.9168 90; 115.85; 90 | 3217.84 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312200 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2784; 12.2509; 16.913 90; 115.856; 90 | 3221.68 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312201 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2356; 12.422; 17.1521 90; 115.776; 90 | 3306.89 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312202 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.246; 12.4606; 17.2256 90; 115.796; 90 | 3332.84 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312203 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2298; 12.446; 17.1989 90; 115.795; 90 | 3320.68 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312204 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.1908; 12.2568; 16.9166 90; 115.826; 90 | 3208.39 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312205 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2287; 12.4404; 17.1874 90; 115.791; 90 | 3316.86 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312206 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3069; 12.2483; 16.9094 90; 115.859; 90 | 3225.54 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312207 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3242; 12.4805; 17.2409 90; 115.753; 90 | 3357.49 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312208 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3655; 12.247; 16.9055 90; 115.856; 90 | 3235.45 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312209 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.1718; 12.26; 16.9206 90; 115.822; 90 | 3206.54 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312210 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.252; 12.4633; 17.2293 90; 115.794; 90 | 3335.49 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312211 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3147; 12.4789; 17.2407 90; 115.757; 90 | 3355.05 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312212 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2283; 12.2566; 16.9197 90; 115.845; 90 | 3215.41 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312213 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.384; 12.2496; 16.9077 90; 115.848; 90 | 3240.23 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312214 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2483; 12.406; 17.1227 90; 115.766; 90 | 3299.66 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312215 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2322; 12.4508; 17.208 90; 115.796; 90 | 3324.15 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312216 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3723; 12.2473; 16.9059 90; 115.855; 90 | 3236.9 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312217 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2362; 12.4545; 17.2151 90; 115.797; 90 | 3327.24 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312218 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2684; 12.252; 16.9141 90; 115.853; 90 | 3220.39 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312219 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2658; 12.468; 17.235 90; 115.787; 90 | 3340.71 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312220 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.2881; 12.2499; 16.9117 90; 115.858; 90 | 3222.91 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312221 | CIF | C38 H28 Fe N6 S2 | P 1 21/c 1 | 17.3795; 12.2872; 16.9515 90; 115.785; 90 | 3259.5 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312222 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9526; 15.1884; 17.6032 90; 90; 90 | 3463.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312223 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3465; 14.7297; 18.2561 90; 90; 90 | 3320.06 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312224 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9265; 15.0011; 17.6167 90; 90; 90 | 3416.08 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312225 | CIF HKL | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3334; 14.6776; 18.2772 90; 90; 90 | 3308.62 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312226 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9195; 14.9581; 17.6206 90; 90; 90 | 3405.2 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312227 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9579; 15.244; 17.5986 90; 90; 90 | 3476.3 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312228 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3375; 14.6932; 18.2706 90; 90; 90 | 3312.05 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312229 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9162; 14.9373; 17.622 90; 90; 90 | 3399.87 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312230 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9231; 14.98; 17.6199 90; 90; 90 | 3411 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312231 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3677; 14.816; 18.2223 90; 90; 90 | 3339.05 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312232 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3441; 14.7212; 18.2597 90; 90; 90 | 3318.15 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312233 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3623; 14.7965; 18.23 90; 90; 90 | 3334.61 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312234 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9388; 15.0788; 17.6121 90; 90; 90 | 3436.15 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312235 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9641; 15.3324; 17.5888 90; 90; 90 | 3496.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312236 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3384; 14.6989; 18.2686 90; 90; 90 | 3313.21 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312237 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9419; 15.1124; 17.608 90; 90; 90 | 3443.8 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312238 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9212; 14.9706; 17.6196 90; 90; 90 | 3408.3 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312239 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3733; 14.8371; 18.2128 90; 90; 90 | 3343.58 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312240 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3481; 14.7388; 18.2524 90; 90; 90 | 3321.87 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312241 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3551; 14.7667; 18.2415 90; 90; 90 | 3328.05 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312242 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9473; 15.1502; 17.6044 90; 90; 90 | 3453.2 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312243 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.34; 14.7047; 18.2655 90; 90; 90 | 3314.38 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312244 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9347; 15.056; 17.6127 90; 90; 90 | 3429.98 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312245 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9442; 15.1256; 17.6073 90; 90; 90 | 3447.31 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312246 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9305; 15.0243; 17.6168 90; 90; 90 | 3422.45 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312247 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9365; 15.0666; 17.6116 90; 90; 90 | 3432.66 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312248 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9607; 15.2577; 17.5967 90; 90; 90 | 3479.8 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312249 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3353; 14.6851; 18.2738 90; 90; 90 | 3310.21 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312250 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3711; 14.826; 18.2181 90; 90; 90 | 3341.45 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312251 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9344; 15.0561; 17.6128 90; 90; 90 | 3429.95 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312252 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9579; 15.2284; 17.5993 90; 90; 90 | 3472.8 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312253 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9555; 15.2018; 17.6028 90; 90; 90 | 3466.8 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312254 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9631; 15.3033; 17.5926 90; 90; 90 | 3490 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312255 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3502; 14.748; 18.249 90; 90; 90 | 3323.89 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312256 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.918; 14.9481; 17.6212 90; 90; 90 | 3402.65 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312257 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9471; 15.1392; 17.6059 90; 90; 90 | 3450.9 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312258 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9639; 15.2874; 17.5947 90; 90; 90 | 3487 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312259 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9567; 15.2136; 17.602 90; 90; 90 | 3469.7 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312260 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3654; 14.8067; 18.226 90; 90; 90 | 3337.01 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312261 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9645; 15.3174; 17.59 90; 90; 90 | 3493.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312262 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9256; 14.9915; 17.6177 90; 90; 90 | 3413.85 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312263 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9498; 15.1732; 17.6021 90; 90; 90 | 3458.6 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312264 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9281; 15.0131; 17.6172 90; 90; 90 | 3419.34 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312265 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3593; 14.7857; 18.2342 90; 90; 90 | 3332.13 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312266 | CIF HKL | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9662; 15.3404; 17.5869 90; 90; 90 | 3498.2 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312267 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9604; 15.2712; 17.5958 90; 90; 90 | 3482.6 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312268 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3525; 14.7569; 18.2457 90; 90; 90 | 3325.91 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312269 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9149; 14.927; 17.6232 90; 90; 90 | 3397.41 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312270 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9419; 15.1014; 17.6085 90; 90; 90 | 3441.42 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312271 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9392; 15.0898; 17.6092 90; 90; 90 | 3438.2 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312272 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3576; 14.7766; 18.2377 90; 90; 90 | 3330.26 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312273 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.3415; 14.7126; 18.2629 90; 90; 90 | 3316.1 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312274 | CIF | C10.86 H8 Fe0.29 N1.71 S0.57 | P c c n | 12.9317; 15.0357; 17.6142 90; 90; 90 | 3424.86 | Shahed, H.; Sharma, N.; Angst, M.; Voigt, J.; Perßon, J; Prakash, P.; Törnroos, K W; Chernyshov, D.; Gildenast, H.; Ohl, M.; Saffarini, G.; Grzechnik, A.; Friese, K. Structural insight into the cooperativity of spin crossover compounds. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 354-367 |
| 2312283 | CIF | Al0.08 B Fe1.183 Mg1.737 O5 | P b a m | 9.2532; 12.3025; 3.0256 90; 90; 90 | 344.43 | Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Bubnova, Rimma S.; Vagizov, Farit G.; Ugolkov, Valery L.; Filatov, Stanislav K.; Pekov, Igor V. Crystal structure refinement, low- and high-temperature X-ray diffraction and Mössbauer spectroscopy study of the oxoborate ludwigite from the Iten'yurginskoe deposit. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312284 | CIF HKL | Cl H26 Na O13 | C 1 2/m 1 | 11.403; 11.882; 10.905 90; 119.475; 90 | 1286.3 | Yamashita, Keishiro; Nakayama, Kazuya; Komatsu, Kazuki; Ohhara, Takashi; Munakata, Koji; Hattori, Takanori; Sano-Furukawa, Asami; Kagi, Hiroyuki The hydrogen-bond network in sodium chloride tridecahydrate: analogy with ice VI. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312285 | CIF HKL | Cl D26 Na O13 | C 1 2/m 1 | 11.3436; 11.8254; 10.8625 90; 119.345; 90 | 1270.15 | Yamashita, Keishiro; Nakayama, Kazuya; Komatsu, Kazuki; Ohhara, Takashi; Munakata, Koji; Hattori, Takanori; Sano-Furukawa, Asami; Kagi, Hiroyuki The hydrogen-bond network in sodium chloride tridecahydrate: analogy with ice VI. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312317 | CIF HKL | C48.5 H35.5 N4 O0.5 | C 1 2/c 1 | 27.946; 7.0236; 21.61 90; 119.031; 90 | 3708.7 | Marchetti, Danilo; Pedrini, Alessandro; Massera, Chiara; Diame, Moussa Faye; Jandl, Christian; Steinfeld, Gunther; Gemmi, Mauro 3D electron diffraction analysis of a novel, mechanochemically synthesized supramolecular organic framework based on tetrakis-4-(4-pyridyl)phenylmethane. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 432-436 |
| 2312318 | CIF HKL | C18 H10 Cl2 N2 O4 | P 1 21 1 | 12.4202; 3.7916; 16.915 90; 107.792; 90 | 758.47 | Anil Kumar, G. N.; Hathwar, Venkatesha R. Quantifying weak interactions in ferroelectric and paraelectric phases of phenazine and chloroanilic acid co-crystal using experimental and theoretical electron densities. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312324 | CIF | Bi2 S Te2 | R -3 m :H | 4.2854; 4.2854; 30.02341 90; 90; 120 | 477.5 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312325 | CIF | Bi4 Pb2 S4 Te4 | R -3 m :H | 4.2701; 4.2701; 40.41287 90; 90; 120 | 638.155 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312326 | CIF | Bi4 Pb2 S4 Te4 | R -3 m :H | 4.27221; 4.27221; 80.7301 90; 90; 120 | 1276.06 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312327 | CIF | Bi4 Pb4 S6 Te4 | P -3 m 1 | 4.25788; 4.25788; 16.9431 90; 90; 120 | 266.018 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312328 | CIF | Bi4 Pb4 S6 Te4 | P -3 m 1 | 4.26052; 4.26052; 33.81797 90; 90; 120 | 531.623 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312329 | CIF | Bi4 Pb6 S8 Te4 | R -3 m :H | 4.25029; 4.25029; 61.24237 90; 90; 120 | 958.12 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312330 | CIF | Bi4 Pb8 S10 Te4 | R -3 m :H | 4.24478; 4.24478; 71.45943 90; 90; 120 | 1115.07 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312331 | CIF | Bi4 Pb10 S12 Te4 | P -3 m 1 | 4.24282; 4.24282; 27.31123 90; 90; 120 | 425.776 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312332 | CIF | Bi4 Pb12 S14 Te4 | R -3 m :H | 4.24175; 4.24175; 92.27622 90; 90; 120 | 1437.84 | Yao, Jie; Ciobanu, Cristiana L.; Cook, Nigel J.; Ehrig, Kathy Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb<sub>n</sub>Bi<sub>4</sub>Te<sub>4</sub>S<sub>n+2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 482-494 |
| 2312335 | CIF HKL Paper | Fe H6 K3 O12 Te2 | I 1 2/m 1 | 12.8036; 14.9042; 5.9782 90; 90.002; 90 | 1140.8 | Wolflehner, Tobias; Stöger, Berthold Order-disorder (OD) polytypism of K<sub>3</sub>FeTe<sub>2</sub>O<sub>8</sub>(OH)<sub>2</sub>(H<sub>2</sub>O)<sub>1+x</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 510-518 |
| 2312336 | CIF HKL | Fe H4.86 K3 O11.43 Te2 | I 1 2/m 1 | 12.766; 14.947; 5.9706 90; 90.047; 90 | 1139.27 | Wolflehner, Tobias; Stöger, Berthold Order-disorder (OD) polytypism of K<sub>3</sub>FeTe<sub>2</sub>O<sub>8</sub>(OH)<sub>2</sub>(H<sub>2</sub>O)<sub>1+x</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 510-518 |
| 2312337 | CIF HKL Paper | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.3; 3.7804; 28.6 90; 129; 90 | 3050 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312338 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.04; 3.6849; 28.44 90; 128.7; 90 | 2948 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312339 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 35.81; 3.6016; 28.27 90; 128.3; 90 | 2861 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312340 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 35.61; 3.5185; 28.11 90; 128; 90 | 2775 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312341 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 35.4; 3.4511; 28.01 90; 127.8; 90 | 2704 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312342 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 35.29; 3.3723; 27.84 90; 127.2; 90 | 2639 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312343 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.468; 3.8405; 28.701 90; 129.39; 90 | 3106.6 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312344 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.007; 3.68425; 28.377 90; 128.63; 90 | 2940.8 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312345 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 35.487; 3.48553; 28.117 90; 128; 90 | 2740.6 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312346 | CIF HKL | C10 H12 K2 N10 O4 | C 1 2/c 1 | 36.007; 3.66703; 28.389 90; 128.68; 90 | 2926 | Gaydamaka, Anna A.; Rashchenko, Sergey V.; Semerikova, Anna I.; Smirnova, Ekaterina S.; Ivanova, Anna G.; Arkhipov, Sergey G.; Zakharov, Boris A.; Bogdanov, Nikita E.; Boldyreva, Elena V. A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K<sup>+</sup>·C<sub>5</sub>H<sub>4</sub>N<sub>5</sub>O<sup>-</sup>·H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312353 | CIF HKL | C26 H30 N2 O2 | P -1 | 8.0045; 9.2035; 15.821 90.211; 102.112; 93.805 | 1136.88 | Zhang, Yanli; Liu, Hui; Chen, Zongxin; Meng, Jialei; Li, Yunfeng; Qi, Luyao; Zhang, Suiliang; Chen, Xiaofeng; Lei, Ming A drug-drug cocrystal and a co-amorphous form, prepared from honokiol and ligustrazine, inspired by Chinese patent medicine. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312354 | CIF HKL Paper | C40 H52 Cd3 Cl2 N4 O10 | P -1 | 9.7566; 10.8671; 11.8861 67.067; 78.948; 66.83 | 1065.92 | Jin, Nanhao; Liu, Yuqi; Dai, Siyu; Li, Yanghua; Wang, Xinying; Zhao, Yue; Liu, Xiaoming; Chen, Han; Luo, Huilong; Li, Wei Design and synthesis of diverse Cd<sup>2+</sup>/Zn<sup>2+</sup>/Cu<sup>2+</sup> coordination polymers tuned by dicarboxylate and auxiliary 1,4-bis(pyridin-4-ylmethyl)piperazine ligands with luminescence and Hirshfeld surface analyses. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312355 | CIF HKL Paper | C44 H80 Cd2 N8 O20 | C 1 2/c 1 | 23.447; 14.4538; 8.7016 90; 96.232; 90 | 2931.5 | Jin, Nanhao; Liu, Yuqi; Dai, Siyu; Li, Yanghua; Wang, Xinying; Zhao, Yue; Liu, Xiaoming; Chen, Han; Luo, Huilong; Li, Wei Design and synthesis of diverse Cd<sup>2+</sup>/Zn<sup>2+</sup>/Cu<sup>2+</sup> coordination polymers tuned by dicarboxylate and auxiliary 1,4-bis(pyridin-4-ylmethyl)piperazine ligands with luminescence and Hirshfeld surface analyses. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312356 | CIF HKL Paper | C24 H26 N4 O6 Zn | P -1 | 9.6423; 10.3812; 12.9847 96.183; 90.257; 115.326 | 1166.1 | Jin, Nanhao; Liu, Yuqi; Dai, Siyu; Li, Yanghua; Wang, Xinying; Zhao, Yue; Liu, Xiaoming; Chen, Han; Luo, Huilong; Li, Wei Design and synthesis of diverse Cd<sup>2+</sup>/Zn<sup>2+</sup>/Cu<sup>2+</sup> coordination polymers tuned by dicarboxylate and auxiliary 1,4-bis(pyridin-4-ylmethyl)piperazine ligands with luminescence and Hirshfeld surface analyses. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312357 | CIF HKL Paper | C20 H26 Cu N4 O6 | C 1 2/m 1 | 8.829; 12.668; 10.008 90; 97.302; 90 | 1110.3 | Jin, Nanhao; Liu, Yuqi; Dai, Siyu; Li, Yanghua; Wang, Xinying; Zhao, Yue; Liu, Xiaoming; Chen, Han; Luo, Huilong; Li, Wei Design and synthesis of diverse Cd<sup>2+</sup>/Zn<sup>2+</sup>/Cu<sup>2+</sup> coordination polymers tuned by dicarboxylate and auxiliary 1,4-bis(pyridin-4-ylmethyl)piperazine ligands with luminescence and Hirshfeld surface analyses. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79 |
| 2312368 | CIF HKL | C18 H19 Cl2 N O4 | P 1 21/n 1 | 11.1017; 12.5717; 13.5023 90; 107.056; 90 | 1801.6 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312369 | CIF HKL | C17 H18 N2 O6 | P 1 21/c 1 | 10.6713; 10.3971; 14.7824 90; 94.545; 90 | 1634.96 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312370 | CIF HKL | C19 H22 N2 O7 | P 1 21/c 1 | 14.0927; 9.2253; 14.5139 90; 97.164; 90 | 1872.21 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312371 | CIF HKL | C20 H24 N2 O6 | P 1 21/n 1 | 10.7862; 15.632; 11.9241 90; 102.528; 90 | 1962.65 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312372 | CIF HKL | C18 H20 N2 O6 | P 1 21/c 1 | 8.8143; 15.3632; 12.9602 90; 93.615; 90 | 1751.52 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312373 | CIF HKL | C27 H28 N2 O7 | F d d 2 | 15.0989; 59.567; 10.954 90; 90; 90 | 9852 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312374 | CIF HKL | C21 H26 N2 O7 | P 1 21/c 1 | 13.8103; 10.7631; 14.8187 90; 104.604; 90 | 2131.51 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312375 | CIF HKL | C23 H32 N2 O8 S | P -1 | 9.505; 11.865; 12.7533 63.606; 77.493; 89.029 | 1252.59 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Hall, Michael J.; Probert, Michael R. High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 4-12 |
| 2312376 | CIF HKL Paper | C10 H8 N2 O2 | P 1 21/c 1 | 4.7332; 14.6353; 12.5289 90; 94.037; 90 | 865.75 | Shishkina, Svitlana V.; Shaposhnyk, Anna M.; Konovalova, Irina S.; Dyakonenko, Victoriya V.; Vaksler, Yevhenii O. Concomitant polymorphs of 2-imino-2H-chromene-3-carboxylic acid amide: experimental and quantum chemical study. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312377 | CIF HKL | C10 H8 N2 O2 | P -1 | 7.0199; 7.072; 9.6216 91.482; 98.773; 109.115 | 444.57 | Shishkina, Svitlana V.; Shaposhnyk, Anna M.; Konovalova, Irina S.; Dyakonenko, Victoriya V.; Vaksler, Yevhenii O. Concomitant polymorphs of 2-imino-2H-chromene-3-carboxylic acid amide: experimental and quantum chemical study. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312378 | CIF HKL Paper | C20 H14 O6 | P 1 21/n 1 | 3.82699; 35.3044; 5.73042 90; 90.336; 90 | 774.22 | Naifert, Sergei A.; Osipov, Artem A.; Efremov, Andrey N.; Rajakumar, Kanthapazham; Uchaev, Daniil A.; Zherebtsov, Dmitry A.; Belov, Kirill N. 1D and 2D coordination polymers with a new rigid chelating linker: diacetylenedisalicylic acid. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312379 | CIF HKL | C20 H17 N O6 | P 1 21/c 1 | 11.5705; 12.5736; 13.5708 90; 91.271; 90 | 1973.83 | Naifert, Sergei A.; Osipov, Artem A.; Efremov, Andrey N.; Rajakumar, Kanthapazham; Uchaev, Daniil A.; Zherebtsov, Dmitry A.; Belov, Kirill N. 1D and 2D coordination polymers with a new rigid chelating linker: diacetylenedisalicylic acid. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312380 | CIF HKL | C51 H53 N5 Na2 O17 | P -1 | 9.0522; 10.7406; 15.0867 71.631; 76.965; 68.737 | 1287.01 | Naifert, Sergei A.; Osipov, Artem A.; Efremov, Andrey N.; Rajakumar, Kanthapazham; Uchaev, Daniil A.; Zherebtsov, Dmitry A.; Belov, Kirill N. 1D and 2D coordination polymers with a new rigid chelating linker: diacetylenedisalicylic acid. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312381 | CIF HKL | Al F H2 O2 | P 1 21/c 1 | 5.1788; 7.8386; 5.1624 90; 116.276; 90 | 187.91 | Zubkova, Natalia V.; Pekov, Igor V.; Ksenofontov, Dmitry A.; Pushcharovsky, Dmitry Yu Zharchikhite, AlF(OH)<sub>2</sub>: a novel structure type related to α-PbO<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312382 | CIF HKL | C30 H32 Cu N10 O6 | P -1 | 8.3305; 8.8175; 11.501 83.096; 72.285; 66.328 | 737.02 | Le Garff, Paul; Maria Losus, Renny; Chaudhary, Simran; Dobrzańska, Liliana Tailoring the dimensionality of metal complexes via ligand modifications. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312383 | CIF HKL | C38 H48 Cu2 N14 O13 | C 1 2/m 1 | 14.5524; 18.5525; 8.1383 90; 90.245; 90 | 2197.19 | Le Garff, Paul; Maria Losus, Renny; Chaudhary, Simran; Dobrzańska, Liliana Tailoring the dimensionality of metal complexes via ligand modifications. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312384 | CIF HKL | C38 H48 Cu2 N12 O12 | P -1 | 7.6782; 12.1895; 12.7801 68.886; 89.049; 79.749 | 1096.55 | Le Garff, Paul; Maria Losus, Renny; Chaudhary, Simran; Dobrzańska, Liliana Tailoring the dimensionality of metal complexes via ligand modifications. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312425 | CIF | Ca8 O16 Si4 | P n m a | 6.776; 5.496; 9.252 90; 90; 90 | 344.553 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312426 | CIF | Ca8 O16 Si4 | P n m a | 6.776; 5.496; 9.252 90; 90; 90 | 344.553 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312427 | CIF | Ca8 O16 Si4 | P n m a | 6.765; 5.514; 9.25 90; 90; 90 | 345.045 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312428 | CIF | Ca8 O16 Si4 | P n m a | 6.765; 5.514; 9.25 90; 90; 90 | 345.045 | Plana-Ruiz, Sergi; Götz, Emilia; Neumann, Thomas; Schwesig, Peter; Kolb, Ute Three-dimensional electron diffraction on clinkers: the belite α'<sub>H</sub> incommensurate modulated structure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 105-116 |
| 2312431 | CIF HKL Paper | C22 H18 O4 | P b c a | 7.2034; 5.961; 37.6935 90; 90; 90 | 1618.54 | Osipov, Artyom A.; Nayfert, Sergey A.; Sobalev, Sergey A.; Rajakumar, Kanthapazham; Zherebtsov, Dmitry A.; Spiridonova, Dar'ya V.; Vinnik, Denis A. Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312432 | CIF HKL Paper | C22 H16 I2 O4 | P 1 21/n 1 | 7.458; 14.6955; 9.7079 90; 111.084; 90 | 992.75 | Osipov, Artyom A.; Nayfert, Sergey A.; Sobalev, Sergey A.; Rajakumar, Kanthapazham; Zherebtsov, Dmitry A.; Spiridonova, Dar'ya V.; Vinnik, Denis A. Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312433 | CIF HKL Paper | C20 H13 K O4 | I 1 2/a 1 | 6.0126; 6.9783; 34.941 90; 93.359; 90 | 1463.53 | Osipov, Artyom A.; Nayfert, Sergey A.; Sobalev, Sergey A.; Rajakumar, Kanthapazham; Zherebtsov, Dmitry A.; Spiridonova, Dar'ya V.; Vinnik, Denis A. Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312434 | CIF HKL Paper | C16 H14 O4 | P b c a | 7.1094; 5.9629; 29.6773 90; 90; 90 | 1258.1 | Osipov, Artyom A.; Nayfert, Sergey A.; Sobalev, Sergey A.; Rajakumar, Kanthapazham; Zherebtsov, Dmitry A.; Spiridonova, Dar'ya V.; Vinnik, Denis A. Effect of a halogen bond on the crystal structure of terphenyldicarboxylic acid derivatives. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312435 | CIF HKL | B2 K O6 Sr Y | P 1 21/m 1 | 6.5888; 5.3664; 8.5293 90; 105.389; 90 | 290.77 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Sofich, Dmitry O.; Sagatov, Nursultan; Gavryushkin, Pavel N.; Vereshchagin, Oleg S.; Bocharov, Vladimir N.; Shevchenko, Vyacheslav S.; Kokh, Alexander E. Growth, crystal structure and IR luminescence of KSrY<sub>1-x</sub>Er<sub>x</sub>(BO<sub>3</sub>)<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312436 | CIF HKL | B6 K3 O18 Sr3 Y3 | R -3 m :H | 5.3798; 5.3798; 17.6988 90; 90; 120 | 443.62 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Sofich, Dmitry O.; Sagatov, Nursultan; Gavryushkin, Pavel N.; Vereshchagin, Oleg S.; Bocharov, Vladimir N.; Shevchenko, Vyacheslav S.; Kokh, Alexander E. Growth, crystal structure and IR luminescence of KSrY<sub>1-x</sub>Er<sub>x</sub>(BO<sub>3</sub>)<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312437 | CIF HKL | B2 K O6 Sr Y | P 1 21/m 1 | 6.594; 5.3718; 8.5241 90; 105.39; 90 | 291.11 | Kuznetsov, Artem B.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Sofich, Dmitry O.; Sagatov, Nursultan; Gavryushkin, Pavel N.; Vereshchagin, Oleg S.; Bocharov, Vladimir N.; Shevchenko, Vyacheslav S.; Kokh, Alexander E. Growth, crystal structure and IR luminescence of KSrY<sub>1-x</sub>Er<sub>x</sub>(BO<sub>3</sub>)<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312438 | CIF Paper | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.0325; 14.0325; 9.9333 90; 90; 120 | 1693.93 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312439 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.1212; 14.1212; 10.2274 90; 90; 120 | 1766.2 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312440 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.0925; 14.0925; 10.1233 90; 90; 120 | 1741.1 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312441 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.0661; 14.0661; 10.0405 90; 90; 120 | 1720.42 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312442 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.0266; 14.0266; 9.9794 90; 90; 120 | 1700.36 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312443 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.9661; 13.9661; 9.8695 90; 90; 120 | 1667.16 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312444 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.9423; 13.9423; 9.8301 90; 90; 120 | 1654.85 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312445 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.9035; 13.9035; 9.7746 90; 90; 120 | 1636.36 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312446 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8794; 13.8794; 9.7474 90; 90; 120 | 1626.15 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312447 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8732; 13.8732; 9.7282 90; 90; 120 | 1621.5 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312448 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8347; 13.8347; 9.6719 90; 90; 120 | 1603.18 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312449 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8133; 13.8133; 9.644 90; 90; 120 | 1593.61 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312450 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.776; 13.776; 9.5808 90; 90; 120 | 1574.63 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312451 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.7392; 13.7392; 9.5341 90; 90; 120 | 1558.59 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312452 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.6805; 13.6805; 9.4433 90; 90; 120 | 1530.59 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312453 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8103; 13.8103; 9.6615 90; 90; 120 | 1595.8 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312454 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.8733; 13.8733; 9.7541 90; 90; 120 | 1625.8 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312455 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 13.9183; 13.9183; 9.8453 90; 90; 120 | 1651.7 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312456 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.0337; 14.0337; 10.0671 90; 90; 120 | 1717 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312457 | CIF | C12 H24 Cl6 O6 Rb Sb | R -3 :H | 14.1078; 14.1078; 10.2256 90; 90; 120 | 1762.5 | Rusanov, Eduard B.; Wörle, Michael D; Kovalenko, Maksym V.; Domasevitch, Kostiantyn V.; Rusanova, Julia A. Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl<sub>6</sub>] under high pressure. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80, 135-145 |
| 2312481 | CIF HKL | Br Co H15 N7 O5 | P n m a | 15.0056; 7.4101; 9.6803 90; 90; 90 | 1076.38 | Kalinina, Polina P.; Marchuk, Alexander S.; Sahoo, Subash; Zakharov, Boris A.; Boldyreva, Elena V. A comparison of the isostructural [Co(NH<sub>3</sub>)<sub>5</sub>NO<sub>2</sub>]XNO<sub>3</sub> and [Co(NH<sub>3</sub>)<sub>5</sub>ONO]XNO<sub>3</sub>, X = Cl<sup>-</sup> or Br<sup>-</sup> in relation to nitro-nitrito linkage isomerization and photomechanical effects. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312482 | CIF HKL | Br Co H15 N7 O5 | P n m a | 14.7201; 7.5516; 9.6879 90; 90; 90 | 1076.91 | Kalinina, Polina P.; Marchuk, Alexander S.; Sahoo, Subash; Zakharov, Boris A.; Boldyreva, Elena V. A comparison of the isostructural [Co(NH<sub>3</sub>)<sub>5</sub>NO<sub>2</sub>]XNO<sub>3</sub> and [Co(NH<sub>3</sub>)<sub>5</sub>ONO]XNO<sub>3</sub>, X = Cl<sup>-</sup> or Br<sup>-</sup> in relation to nitro-nitrito linkage isomerization and photomechanical effects. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312486 | CIF Paper | C9 H9 Cl2 N5 O | P 1 21/n 1 | 9.3283; 9.8379; 12.9148 90; 101.405; 90 | 1161.8 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312487 | CIF Paper | C11 H13 Cl2 N5 O | P 1 21/n 1 | 7.6894; 11.3816; 15.9147 90; 92.71; 90 | 1391.26 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312488 | CIF Paper | C11 H13 Cl2 N5 O | C 1 2/c 1 | 21.268; 10.45; 19.085 90; 136.662; 90 | 2911 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312489 | CIF Paper | C12 H13 Cl2 N5 O | P -1 | 7.1227; 10.6434; 10.9101 94.031; 100.823; 107.105 | 769.47 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312490 | CIF Paper | C15 H23 Cl2 N5 O2 | P 1 21/n 1 | 10.5757; 12.8768; 15.0121 90; 95.258; 90 | 2035.8 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312491 | CIF Paper | C13 H17 Cl2 N5 O | P -1 | 10.8596; 11.4487; 15.5823 98.562; 101.242; 115.425 | 1655.9 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312492 | CIF Paper | C17 H27 Cl2 N5 O2 | P -1 | 7.437; 10.302; 14.811 79.7; 85.34; 88.71 | 1112.7 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312493 | CIF Paper | C14 H21 Cl2 N5 O2 | P -1 | 7.6284; 8.5181; 14.519 84.043; 75.989; 85.943 | 909.41 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312494 | CIF Paper | C23 H17 Cl2 N7 | P -1 | 10.3096; 10.6257; 12.0489 74.28; 75.318; 67.161 | 1154.46 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312495 | CIF Paper | C11 H10 Cl2 N6 | P -1 | 7.9855; 8.6004; 10.9109 69.598; 82.227; 82.015 | 692.48 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312496 | CIF Paper | C11 H13 Cl2 N5 O S | P 1 21/n 1 | 10.6626; 7.3529; 19.6714 90; 92.096; 90 | 1541.23 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312497 | CIF Paper | C24 H26 Cl4 N10 O3 | P -1 | 10.2684; 10.7665; 14.9036 71.197; 78.435; 74.957 | 1493.9 | Pavlović, Gordana; Lekšić, Edislav; Meštrović, Ernest Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312498 | CIF | Ge4 N4 O4 Sn | P 63 m c | 5.876; 5.876; 9.418 90; 90; 120 | 281.6 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312499 | CIF | Ge4.158 N4 O4 Sn0.842 | P 63 m c | 5.839; 5.839; 9.365 90; 90; 120 | 276.51 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312500 | CIF | Ge24 N24 O24 Sn6 | R -3 m :H | 5.846; 5.846; 28.23 90; 90; 120 | 835.5 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312501 | CIF | Ge24 N24 O24 Sn6 | R -3 m :H | 5.846; 5.846; 28.23 90; 90; 120 | 835.5 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 2312502 | CIF HKL | Cs4 H5 O16 P S3 | C 1 2/c 1 | 19.95; 7.856; 8.98 90; 100.12; 90 | 1386 | Makarova, Irina P.; Isakova, Natalia N.; Kalyukanov, Andrey I.; Gainutdinov, Radmir V.; Tolstikhina, Alla L.; Komornikov, Vladimir A. Features of the crystal structure and surface of superprotonic conductor caesium hydrogen sulfate phosphate. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
| 5000003 | CIF | C4 H10 N2 O4 | P 21 21 21 | 5.593; 9.827; 11.808 90; 90; 90 | 649 | Verbist, J. J.; Lehmann, M. S.; Koetzle, T. F.; Hamilton, W. C. Precision neutron diffraction structure determination of protein and nucleic acid components. VI. The crystal and molecular structure of the amino acid L-asparagine monohydrate Acta Crystallographica Section B, 1972, 28, 3006-3013 |
| 5000004 | CIF | C4 H7 N O4 | P 1 21 1 | 7.617; 6.982; 5.142 90; 99.84; 90 | 269.44 | Derissen, J. L.; Endeman, H. J.; Peerdeman, A. F. The crystal and molecular structure of L-aspartic acid Acta Crystallographica Section B, 1968, 24, 1349-1354 |
| 5000006 | CIF | C5 H10 N2 O3 | P 21 21 21 | 16.02; 7.762; 5.119 90; 90; 90 | 636.53 | Koetzle, T. F.; Frey, M. N.; Lehmann, M. S.; Hamilton, W. C. Precision neutron diffraction structure determination of protein and nucleic acid components. XIII. Molecular and crystal structure of the amino acid L-glutamine Acta Crystallographica Section B, 1973, 29, 2571-2575 |
| 5000007 | CIF Paper | C5 H10 Cl N O4 | P 21 21 21 | 5.151; 11.789; 13.347 90; 90; 90 | 810.5 | Sequeira, A.; Rajagopal, H.; Chidambaram, R. A neutron diffraction study of the structure of L-glutamic acid.HCl Acta Crystallographica Section B, 1972, 28, 2514-2519 |
| 5000009 | CIF | C6 H9 N3 O2 | P 1 21 1 | 5.172; 7.384; 9.474 90; 97.162; 90 | 358.99 | Madden, J. J.; McGandy, E. L.; Seeman, N. C.; Harding, M. M.; Hoy, A. The crystal structure of the monoclinic form of L-histidine Acta Crystallographica Section B, 1972, 28, 2382-2389 |
| 5000011 | CIF | C6 H19 Cl N2 O4 | P 1 21 1 | 7.492; 13.32; 5.879 90; 97.79; 90 | 581.27 | Koetzle, T. F.; Lehmann, M. S.; Verbist, J. J.; Hamilton, W. C. Precision neutron diffraction structure determination of protein and nucleic acid components. VII. The crystal and molecular structure of the amino acid L-lysine monohydrochloride dihydrate Acta Crystallographica Section B, 1972, 28, 3207-3214 |
| 5000013 | CIF | C9 H12 Cl N O2 | P 21 21 21 | 27.763; 7.059; 5.38 90; 90; 90 | 1054.37 | Al-Karaghouli, A. R.; Koetzle, T. F. Neutron diffraction study of L-phenylalanine hydrochloride Acta Crystallographica Section B, 1975, 31, 2461-2465 |
| 5000015 | CIF | C3 H7 N O3 | P 21 21 21 | 8.599; 9.348; 5.618 90; 90; 90 | 451.59 | Kistenmacher, T. J.; Rand, G. A.; Marsh, R. E. Refinements of the crystal structures of DL-serine and anhydrous L-serine Acta Crystallographica Section B, 1974, 30, 2573-2578 |
| 5000018 | CIF | C10 H13 N5 O4 | P 1 21 1 | 4.825; 10.282; 11.823 90; 99.3; 90 | 578.84 | Lai, T. F.; Marsh, R. E. The crystal structure of adenosine Acta Crystallographica Section B, 1972, 28, 1982-1989 |
| 5000020 | CIF | C10 H17 N5 O7 | P 1 21 1 | 17.518; 11.502; 6.658 90; 98.17; 90 | 1327.92 | Thewalt, U.; Bugg, C. E.; Marsh, R. E. The crystal structure of guanosine dihydrate and inosine dihydrate Acta Crystallographica Section B, 1970, 26, 1089-1101 |
| 5000021 | CIF | C10 H14 N2 O5 | P 21 21 21 | 4.86; 13.91; 16.32 90; 90; 90 | 1103.27 | Young, D. W.; Tollin, P.; Wilson, H. R. The crystal and molecular structure of thymidine Acta Crystallographica Section B, 1969, 25, 1423-1432 |
| 5000022 | CIF | C12 H18 N2 O10 | P 1 21 1 | 11.159; 14.461; 4.821 90; 101.15; 90 | 763.28 | Morikawa, K.; Torii, K.; Iitaka, Y.; Tsuboi, M. Uridine-5-oxyacetic acid methyl ester monohydrate Acta Crystallographica Section B, 1975, 31, 1004-1007 |
| 5000023 | CIF | C12 H8 Cl2 | P 1 21/n 1 | 15.78; 13.74; 9.682 90; 96.23; 90 | 2086.83 | Brock, C. P.; Kuo, M. S.; Levy, H. A. 4,4'-Dichlorobiphenyl: crystal packing in para-substituted biphenyls Acta Crystallographica Section B, 1978, 34, 981-985 |
| 5000024 | CIF | C12 Cl10 | P b c n | 13.372; 10.497; 11.992 90; 90; 90 | 1683.27 | Pedersen, B. Decachlorobiphenyl, C~12~Cl~10~: the crystal and molecular structure Acta Crystallographica Section B, 1975, 31, 2931-2933 |
| 5000031 | CIF | C18 H25 O2.499 | P 21 21 2 | 12.055; 19.28; 6.63 90; 90; 90 | 1540.95 | Busetta, B.; Hospital, M. Structure cristalline et moleculaire de l'oestradiol hemihydrate Acta Crystallographica Section B, 1972, 28, 560-567 |
| 5000032 | CIF | C18 H22 O2 | P 21 21 21 | 10.043; 18.424; 7.787 90; 90; 90 | 1440.85 | Busetta, B.; Courseille, C.; Hospital, M. Structure cristallines et moleculaires de trois formes polymorphes de l'oestrone Acta Crystallographica Section B, 1973, 29, 298-313 |
| 5000038 | CIF | O2 Zr | F m -3 m | 5.1291; 5.1291; 5.1291 90; 90; 90 | 134.9 | Martin, U; Boysen, H; Frey, F Neutron powder investigation of tetragonal and cubic stabilized zirconia, TZP and CSZ, at temperatures up to 1400 K Acta Crystallographica Section B, 1993, 49, 403-413 |
| 5000063 | CIF | C6 H8 O7 | P 1 21/a 1 | 12.817; 5.628; 11.465 90; 111.22; 90 | 770.94 | Glusker, J. P.; Minkin, J. A.; Patterson, A. L. X-ray crystal analysis of the substrates of aconitase. IX. A refinement of the structure of anhydrous citric acid Acta Crystallographica Section B, 1969, 25, 1066-1072 |
| 5000065 | CIF | C6 H12 O6 | P 21 21 21 | 8.088; 9.204; 10.034 90; 90; 90 | 746.95 | Kanters, J. A.; Roelofsen, G.; Alblas, B. P.; Meinders, I. The crystal and molecular structure of β-d-fructose, with emphasis on anomeric effect and hydrogen-bond interactions Acta Crystallographica Section B, 1977, 33, 665-672 |
| 5000078 | CIF | C4 H3 F N2 O2 | P -1 | 9.22; 12.66; 12.67 89.7; 43.9; 98.6 | 1000.08 | Fallon, III, L. The crystal and molecular structure of 5-fluorouracil Acta Crystallographica Section B, 1973, 29, 2549-2556 |
| 5000084 | CIF | C22 H29 F O4 | P 21 21 21 | 11.319; 22.803; 7.381 90; 90; 90 | 1905.09 | Dupont, L.; Dideberg, O.; Campsteyn, H. Structure cristalline de la l7-désoxyméthasone, C~22~H~29~O~4~F Acta Crystallographica Section B, 1974, 30, 514-516 |
| 5000102 | CIF | C17 H19 N O3 | P 1 21/n 1 | 8.743; 13.364; 13.147 90; 108.66; 90 | 1455.37 | Grynpas, M.; Lindley, P. F. The crystal and molecular structure of 1-piperoylpiperidine Acta Crystallographica Section B, 1975, 31, 2663-2667 |
| 5000111 | CIF | C27 H46 O | P 1 | 14.172; 34.209; 10.481 94.64; 90.67; 96.32 | 5032.77 | Shieh, H.-S.; Hoard, L. G.; Nordman, C. E. The structure of cholesterol Acta Crystallographica Section B, 1981, 37, 1538-1543 |
| 5000131 | CIF | C5 H6 N4 O S | C 1 2/c 1 | 15.294; 7.732; 12.379 90; 101.64; 90 | 1433.75 | Sletten, E.; Sletten, J.; Jensen, L. H. The crystal and molecular structure of 6-mercaptopurine monohydrate Acta Crystallographica Section B, 1969, 25, 1330-1338 |
| 5000140 | CIF | C6 H2 Cl N3 O6 | P 1 21/a 1 | 11.02; 6.795; 14.964 90; 124.15; 90 | 927.31 | Willis, J. S.; Stewart, J. M.; Ammon, H. L.; Preston, H. S.; Gluyas, R. E.; Harris, P. M. The crystal structure of picryl chloride Acta Crystallographica Section B, 1971, 27, 786-793 |
| 5000142 | CIF | C6 H4 N2 O5 | P 21 21 21 | 6.106; 23.24; 5.168 90; 90; 90 | 733.36 | Kagawa, T.; Kawai, R.; Kashino, S.; Haisa, M. The crystal and molecular structure of 2,4-dinitrophenol Acta Crystallographica Section B, 1976, 32, 3171-3175 |
| 5000144 | CIF | C H4 N4 O2 | F d d 2 | 17.6152; 24.8502; 3.588 90; 90; 90 | 1570.62 | Choi, C. S. Refinement of 2-nitroguanidine by neutron powder diffraction Acta Crystallographica Section B, 1981, 37, 1955-1957 |
| 5000148 | CIF | C3 H6 N6 O6 | P b c a | 13.182; 11.574; 10.709 90; 90; 90 | 1633.86 | Choi, C. S.; Prince, E. The crystal structure of cyclotrimethylenetrinitramine Acta Crystallographica Section B, 1972, 28, 2857-2862 |
| 5000150 | CIF | C6 H3 N3 O6 | P b c a | 9.78; 26.94; 12.82 90; 90; 90 | 3377.73 | Choi, C. S.; Abel, J. E. The crystal structure of 1,3,5-trinitrobenzene by neutron diffraction Acta Crystallographica Section B, 1972, 28, 193-201 |
| 5000151 | CIF | C6 H4.339 N3 O8.669 | P -3 c 1 | 12.6077; 12.6077; 10.1147 90; 90; 120 | 1392.37 | Pierce-Butler, M. Structures of 2,4,6-trinitro-1.3-benzenediol 2/3-hydrate and 2,4,6-trinitro-1,3,5-benzenetriol 2/3-hydrate Acta Crystallographica Section B, 1982, 38, 3097-3100 |
| 5000152 | CIF | C H5 N3 O4 | P 1 21/c 1 | 9.543; 8.201; 7.498 90; 124.25; 90 | 485.05 | Worsham, Jr, J. E.; Busing, W. R. The crystal structure of uronium nitrate (urea nitrate) by neutron diffraction Acta Crystallographica Section B, 1969, 25, 572-578 |
| 5000153 | CIF | C H6 N4 S | P 1 21/c 1 | 4.74; 15.53; 7.19 90; 122.4; 90 | 446.88 | Braibanti, A.; Tiripicchio, A.; Camellini, M. T. Crystal and molecular structure of thiocarbohydrazide Acta Crystallographica Section B, 1969, 25, 2286-2290 |
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