Crystallography Open Database

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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials' volume of publication is 80

COD ID: 2023151
CIF file Formula: - C11 H8 N3 O5 Zn -
Comments: Farahmand Kateshali, Arash; Soleimannejad, Janet; Janczak, Jan Ultrasound-assisted synthesis of a Eu3±functionalized ZnII coordination polymer as a fluorescent dual detection probe for highly sensitive recognition of HgII and L-Cys Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(3) (2024) 208-218
Space group: C 1 2/c 1
Cell volume: 2495.4
Cell parameters: 35.421; 9.928; 7.1277; 90; 95.396; 90;  

COD ID: 2023223
CIF file

HKL data

Original IUCr paper

Formula: - C36 H38.6 Cl2 Cu N8 O11.3 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1056.59
Cell parameters: 8.8398; 9.9196; 12.8239; 97.633; 93.948; 107.385;  

COD ID: 2023224
CIF file

HKL data

Formula: - C38 H40 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1084.99
Cell parameters: 9.3557; 9.838; 13.0238; 75.71; 89.649; 69.657;  

COD ID: 2023225
CIF file

HKL data

Formula: - C40 H44 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1086.13
Cell parameters: 9.3377; 9.7888; 12.987; 103.114; 90.344; 109.408;  

COD ID: 2023226
CIF file

HKL data

Formula: - C42 H48 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1117.04
Cell parameters: 9.1329; 10.0787; 13.0825; 103.496; 94.562; 105.229;  

COD ID: 2023227
CIF file

HKL data

Formula: - C44 H52 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1157.64
Cell parameters: 9.4157; 9.9855; 13.6726; 106.181; 96.455; 106.527;  

COD ID: 2023228
CIF file

HKL data

Formula: - C42 H46 Cl2 Cu N10 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1142.38
Cell parameters: 9.1544; 9.8343; 14.2557; 91.493; 107.948; 109.075;  

COD ID: 2023229
CIF file

HKL data

Formula: - C42 H44 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1067.61
Cell parameters: 9.4814; 9.7136; 13.3146; 69.117; 80.66; 68.833;  

COD ID: 2023230
CIF file

HKL data

Formula: - C44 H48 Cl2 Cu N8 O10 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P 1 21/n 1
Cell volume: 2176.2
Cell parameters: 9.0943; 25.0287; 10.0253; 90; 107.509; 90;  

COD ID: 2023231
CIF file

HKL data

Original IUCr paper

Formula: - C44 H48 Cl2 Cu N8 O12 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1130.6
Cell parameters: 9.3679; 10.2347; 12.5311; 79.661; 84.578; 73.249;  

COD ID: 2023232
CIF file

HKL data

Original IUCr paper

Formula: - C44 H48 Cl2 Cu N8 O12 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1137.37
Cell parameters: 10.0363; 10.1867; 11.9902; 83.078; 82.032; 70.015;  

COD ID: 2023233
CIF file

HKL data

Original IUCr paper

Formula: - C40 H42 Cl2 Cu N8 O9 -
Comments: Loukopoulos, Edward; Papatriantafyllopoulou, Constantina; Moushi, Eleni; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(Pt 4) (2024) 347-359
Space group: P -1
Cell volume: 1023.61
Cell parameters: 8.6577; 9.8396; 12.82; 97.084; 93.897; 108.096;  

COD ID: 2023289
CIF file

HKL data

Formula: - Mn13 Zn126.044 -
Comments: Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim Synthesis and structural study of the partially disordered complex hexagonal phase δ<sub>1</sub>-MnZn<sub>9.7</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 688-694
Space group: P 63/m m c
Cell volume: 8313.3
Cell parameters: 12.9051; 12.9051; 57.6398; 90; 90; 120;  

COD ID: 2023290
CIF file

HKL data

Formula: - Mn13 Zn126.103 -
Comments: Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim Synthesis and structural study of the partially disordered complex hexagonal phase δ<sub>1</sub>-MnZn<sub>9.7</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 688-694
Space group: P 63/m m c
Cell volume: 8319.6
Cell parameters: 12.9085; 12.9085; 57.6528; 90; 90; 120;  

COD ID: 2023307
CIF file

HKL data

Original IUCr paper

Formula: - C4 H20 Br6 N4 Zn -
Comments: Czapla, Zbigniew; Krawczyk, Monika K.; Kinzhybalo, Vasyl Atypical phase transition, twinning and ferroelastic domain structure in bis(ethylenediammonium) tetrabromozincate(II) bromide, [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>NH<sub>3</sub>]<sub>2</sub>[ZnBr<sub>4</sub>]Br<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 738-745
Space group: P 1 21/m 1
Cell volume: 844.5
Cell parameters: 6.394; 19.838; 6.668; 90; 93.18; 90;  

COD ID: 2023308
CIF file

HKL data

Original IUCr paper

Formula: - C4 H20 Br6 N4 Zn -
Comments: Czapla, Zbigniew; Krawczyk, Monika K.; Kinzhybalo, Vasyl Atypical phase transition, twinning and ferroelastic domain structure in bis(ethylenediammonium) tetrabromozincate(II) bromide, [NH<sub>3</sub>(CH<sub>2</sub>)<sub>2</sub>NH<sub>3</sub>]<sub>2</sub>[ZnBr<sub>4</sub>]Br<sub>2</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 738-745
Space group: P 1 21/m 1
Cell volume: 862.3
Cell parameters: 6.438; 19.945; 6.726; 90; 93.16; 90;  

COD ID: 2023309
CIF file

HKL data

Original IUCr paper

Formula: - C17 H14 F6 S2 -
Comments: Isobe, Mami; Kitagawa, Daichi; Kobatake, Seiya Morphological control for hollow rod crystals of a photochromic diarylethene on spherulites by surface properties of substrates. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 732-737
Space group: P 1 21/c 1
Cell volume: 3410
Cell parameters: 12.047; 17.4; 16.281; 90; 92.306; 90;  

COD ID: 2312368
CIF file

HKL data

Formula: - C18 H19 Cl2 N O4 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/n 1
Cell volume: 1801.6
Cell parameters: 11.1017; 12.5717; 13.5023; 90; 107.056; 90;  

COD ID: 2312369
CIF file

HKL data

Formula: - C17 H18 N2 O6 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/c 1
Cell volume: 1634.96
Cell parameters: 10.6713; 10.3971; 14.7824; 90; 94.545; 90;  

COD ID: 2312370
CIF file

HKL data

Formula: - C19 H22 N2 O7 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/c 1
Cell volume: 1872.21
Cell parameters: 14.0927; 9.2253; 14.5139; 90; 97.164; 90;  

COD ID: 2312371
CIF file

HKL data

Formula: - C20 H24 N2 O6 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/n 1
Cell volume: 1962.65
Cell parameters: 10.7862; 15.632; 11.9241; 90; 102.528; 90;  

COD ID: 2312372
CIF file

HKL data

Formula: - C18 H20 N2 O6 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/c 1
Cell volume: 1751.52
Cell parameters: 8.8143; 15.3632; 12.9602; 90; 93.615; 90;  

COD ID: 2312373
CIF file

HKL data

Formula: - C27 H28 N2 O7 -
Comments: 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 80(1) (2024) 4-12
Space group: F d d 2
Cell volume: 9852
Cell parameters: 15.0989; 59.567; 10.954; 90; 90; 90;  

COD ID: 2312374
CIF file

HKL data

Formula: - C21 H26 N2 O7 -
Comments: 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 80(1) (2024) 4-12
Space group: P 1 21/c 1
Cell volume: 2131.51
Cell parameters: 13.8103; 10.7631; 14.8187; 90; 104.604; 90;  

COD ID: 2312375
CIF file

HKL data

Formula: - C23 H32 N2 O8 S -
Comments: 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 80(1) (2024) 4-12
Space group: P -1
Cell volume: 1252.59
Cell parameters: 9.505; 11.865; 12.7533; 63.606; 77.493; 89.029;  

COD ID: 2312376
CIF file

HKL data

Original IUCr paper

Formula: - C10 H8 N2 O2 -
Comments: 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 80(1) (2024)
Space group: P 1 21/c 1
Cell volume: 865.75
Cell parameters: 4.7332; 14.6353; 12.5289; 90; 94.037; 90;  

COD ID: 2312377
CIF file

HKL data

Formula: - C10 H8 N2 O2 -
Comments: 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 80(1) (2024)
Space group: P -1
Cell volume: 444.57
Cell parameters: 7.0199; 7.072; 9.6216; 91.482; 98.773; 109.115;  

COD ID: 2312378
CIF file

HKL data

Original IUCr paper

Formula: - C20 H14 O6 -
Comments: 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 80(1) (2024)
Space group: P 1 21/n 1
Cell volume: 774.22
Cell parameters: 3.82699; 35.3044; 5.73042; 90; 90.336; 90;  

COD ID: 2312379
CIF file

HKL data

Formula: - C20 H17 N O6 -
Comments: 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 80(1) (2024)
Space group: P 1 21/c 1
Cell volume: 1973.83
Cell parameters: 11.5705; 12.5736; 13.5708; 90; 91.271; 90;  

COD ID: 2312380
CIF file

HKL data

Formula: - C51 H53 N5 Na2 O17 -
Comments: 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 80(1) (2024)
Space group: P -1
Cell volume: 1287.01
Cell parameters: 9.0522; 10.7406; 15.0867; 71.631; 76.965; 68.737;  

COD ID: 2312381
CIF file

HKL data

Formula: - Al F H2 O2 -
Comments: 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 80(1) (2024)
Space group: P 1 21/c 1
Cell volume: 187.91
Cell parameters: 5.1788; 7.8386; 5.1624; 90; 116.276; 90;  

COD ID: 2312382
CIF file

HKL data

Formula: - C30 H32 Cu N10 O6 -
Comments: 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 80(1) (2024)
Space group: P -1
Cell volume: 737.02
Cell parameters: 8.3305; 8.8175; 11.501; 83.096; 72.285; 66.328;  

COD ID: 2312383
CIF file

HKL data

Formula: - C38 H48 Cu2 N14 O13 -
Comments: 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 80(1) (2024)
Space group: C 1 2/m 1
Cell volume: 2197.19
Cell parameters: 14.5524; 18.5525; 8.1383; 90; 90.245; 90;  

COD ID: 2312384
CIF file

HKL data

Formula: - C38 H48 Cu2 N12 O12 -
Comments: 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 80(1) (2024)
Space group: P -1
Cell volume: 1096.55
Cell parameters: 7.6782; 12.1895; 12.7801; 68.886; 89.049; 79.749;  

COD ID: 2312425
CIF file Formula: - Ca8 O16 Si4 -
Comments: 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 80(Pt 2) (2024) 105-116
Space group: P n m a
Cell volume: 344.553
Cell parameters: 6.776; 5.496; 9.252; 90; 90; 90;  

COD ID: 2312426
CIF file Formula: - Ca8 O16 Si4 -
Comments: 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 80(Pt 2) (2024) 105-116
Space group: P n m a
Cell volume: 344.553
Cell parameters: 6.776; 5.496; 9.252; 90; 90; 90;  

COD ID: 2312427
CIF file Formula: - Ca8 O16 Si4 -
Comments: 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 80(Pt 2) (2024) 105-116
Space group: P n m a
Cell volume: 345.045
Cell parameters: 6.765; 5.514; 9.25; 90; 90; 90;  

COD ID: 2312428
CIF file Formula: - Ca8 O16 Si4 -
Comments: 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 80(Pt 2) (2024) 105-116
Space group: P n m a
Cell volume: 345.045
Cell parameters: 6.765; 5.514; 9.25; 90; 90; 90;  

COD ID: 2312431
CIF file

HKL data

Original IUCr paper

Formula: - C22 H18 O4 -
Comments: 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 80(2) (2024)
Space group: P b c a
Cell volume: 1618.54
Cell parameters: 7.2034; 5.961; 37.6935; 90; 90; 90;  

COD ID: 2312432
CIF file

HKL data

Original IUCr paper

Formula: - C22 H16 I2 O4 -
Comments: 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 80(2) (2024)
Space group: P 1 21/n 1
Cell volume: 992.75
Cell parameters: 7.458; 14.6955; 9.7079; 90; 111.084; 90;  

COD ID: 2312433
CIF file

HKL data

Original IUCr paper

Formula: - C20 H13 K O4 -
Comments: 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 80(2) (2024)
Space group: I 1 2/a 1
Cell volume: 1463.53
Cell parameters: 6.0126; 6.9783; 34.941; 90; 93.359; 90;  

COD ID: 2312434
CIF file

HKL data

Original IUCr paper

Formula: - C16 H14 O4 -
Comments: 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 80(2) (2024)
Space group: P b c a
Cell volume: 1258.1
Cell parameters: 7.1094; 5.9629; 29.6773; 90; 90; 90;  

COD ID: 2312435
CIF file

HKL data

Formula: - B2 K O6 Sr Y -
Comments: 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 80(2) (2024)
Space group: P 1 21/m 1
Cell volume: 290.77
Cell parameters: 6.5888; 5.3664; 8.5293; 90; 105.389; 90;  

COD ID: 2312436
CIF file

HKL data

Formula: - B6 K3 O18 Sr3 Y3 -
Comments: 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 80(2) (2024)
Space group: R -3 m :H
Cell volume: 443.62
Cell parameters: 5.3798; 5.3798; 17.6988; 90; 90; 120;  

COD ID: 2312437
CIF file

HKL data

Formula: - B2 K O6 Sr Y -
Comments: 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 80(2) (2024)
Space group: P 1 21/m 1
Cell volume: 291.11
Cell parameters: 6.594; 5.3718; 8.5241; 90; 105.39; 90;  

COD ID: 2312438
CIF file

Original IUCr paper

Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1693.93
Cell parameters: 14.0325; 14.0325; 9.9333; 90; 90; 120;  

COD ID: 2312439
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1766.2
Cell parameters: 14.1212; 14.1212; 10.2274; 90; 90; 120;  

COD ID: 2312440
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1741.1
Cell parameters: 14.0925; 14.0925; 10.1233; 90; 90; 120;  

COD ID: 2312441
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1720.42
Cell parameters: 14.0661; 14.0661; 10.0405; 90; 90; 120;  

COD ID: 2312442
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1700.36
Cell parameters: 14.0266; 14.0266; 9.9794; 90; 90; 120;  

COD ID: 2312443
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1667.16
Cell parameters: 13.9661; 13.9661; 9.8695; 90; 90; 120;  

COD ID: 2312444
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1654.85
Cell parameters: 13.9423; 13.9423; 9.8301; 90; 90; 120;  

COD ID: 2312445
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1636.36
Cell parameters: 13.9035; 13.9035; 9.7746; 90; 90; 120;  

COD ID: 2312446
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1626.15
Cell parameters: 13.8794; 13.8794; 9.7474; 90; 90; 120;  

COD ID: 2312447
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1621.5
Cell parameters: 13.8732; 13.8732; 9.7282; 90; 90; 120;  

COD ID: 2312448
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1603.18
Cell parameters: 13.8347; 13.8347; 9.6719; 90; 90; 120;  

COD ID: 2312449
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1593.61
Cell parameters: 13.8133; 13.8133; 9.644; 90; 90; 120;  

COD ID: 2312450
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1574.63
Cell parameters: 13.776; 13.776; 9.5808; 90; 90; 120;  

COD ID: 2312451
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1558.59
Cell parameters: 13.7392; 13.7392; 9.5341; 90; 90; 120;  

COD ID: 2312452
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1530.59
Cell parameters: 13.6805; 13.6805; 9.4433; 90; 90; 120;  

COD ID: 2312453
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1595.8
Cell parameters: 13.8103; 13.8103; 9.6615; 90; 90; 120;  

COD ID: 2312454
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1625.8
Cell parameters: 13.8733; 13.8733; 9.7541; 90; 90; 120;  

COD ID: 2312455
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1651.7
Cell parameters: 13.9183; 13.9183; 9.8453; 90; 90; 120;  

COD ID: 2312456
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1717
Cell parameters: 14.0337; 14.0337; 10.0671; 90; 90; 120;  

COD ID: 2312457
CIF file Formula: - C12 H24 Cl6 O6 Rb Sb -
Comments: 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 80(Pt 2) (2024) 135-145
Space group: R -3 :H
Cell volume: 1762.5
Cell parameters: 14.1078; 14.1078; 10.2256; 90; 90; 120;  

COD ID: 2312481
CIF file

HKL data

Formula: - Br Co H15 N7 O5 -
Comments: 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 80(3) (2024)
Space group: P n m a
Cell volume: 1076.38
Cell parameters: 15.0056; 7.4101; 9.6803; 90; 90; 90;  

COD ID: 2312482
CIF file

HKL data

Formula: - Br Co H15 N7 O5 -
Comments: 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 80(3) (2024)
Space group: P n m a
Cell volume: 1076.91
Cell parameters: 14.7201; 7.5516; 9.6879; 90; 90; 90;  

COD ID: 2312486
CIF file

Original IUCr paper

Formula: - C9 H9 Cl2 N5 O -
Comments: 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 80(3) (2024)
Space group: P 1 21/n 1
Cell volume: 1161.8
Cell parameters: 9.3283; 9.8379; 12.9148; 90; 101.405; 90;  

COD ID: 2312487
CIF file

Original IUCr paper

Formula: - C11 H13 Cl2 N5 O -
Comments: 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 80(3) (2024)
Space group: P 1 21/n 1
Cell volume: 1391.26
Cell parameters: 7.6894; 11.3816; 15.9147; 90; 92.71; 90;  

COD ID: 2312488
CIF file

Original IUCr paper

Formula: - C11 H13 Cl2 N5 O -
Comments: 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 80(3) (2024)
Space group: C 1 2/c 1
Cell volume: 2911
Cell parameters: 21.268; 10.45; 19.085; 90; 136.662; 90;  

COD ID: 2312489
CIF file

Original IUCr paper

Formula: - C12 H13 Cl2 N5 O -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 769.47
Cell parameters: 7.1227; 10.6434; 10.9101; 94.031; 100.823; 107.105;  

COD ID: 2312490
CIF file

Original IUCr paper

Formula: - C15 H23 Cl2 N5 O2 -
Comments: 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 80(3) (2024)
Space group: P 1 21/n 1
Cell volume: 2035.8
Cell parameters: 10.5757; 12.8768; 15.0121; 90; 95.258; 90;  

COD ID: 2312491
CIF file

Original IUCr paper

Formula: - C13 H17 Cl2 N5 O -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 1655.9
Cell parameters: 10.8596; 11.4487; 15.5823; 98.562; 101.242; 115.425;  

COD ID: 2312492
CIF file

Original IUCr paper

Formula: - C17 H27 Cl2 N5 O2 -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 1112.7
Cell parameters: 7.437; 10.302; 14.811; 79.7; 85.34; 88.71;  

COD ID: 2312493
CIF file

Original IUCr paper

Formula: - C14 H21 Cl2 N5 O2 -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 909.41
Cell parameters: 7.6284; 8.5181; 14.519; 84.043; 75.989; 85.943;  

COD ID: 2312494
CIF file

Original IUCr paper

Formula: - C23 H17 Cl2 N7 -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 1154.46
Cell parameters: 10.3096; 10.6257; 12.0489; 74.28; 75.318; 67.161;  

COD ID: 2312495
CIF file

Original IUCr paper

Formula: - C11 H10 Cl2 N6 -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 692.48
Cell parameters: 7.9855; 8.6004; 10.9109; 69.598; 82.227; 82.015;  

COD ID: 2312496
CIF file

Original IUCr paper

Formula: - C11 H13 Cl2 N5 O S -
Comments: 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 80(3) (2024)
Space group: P 1 21/n 1
Cell volume: 1541.23
Cell parameters: 10.6626; 7.3529; 19.6714; 90; 92.096; 90;  

COD ID: 2312497
CIF file

Original IUCr paper

Formula: - C24 H26 Cl4 N10 O3 -
Comments: 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 80(3) (2024)
Space group: P -1
Cell volume: 1493.9
Cell parameters: 10.2684; 10.7665; 14.9036; 71.197; 78.435; 74.957;  

COD ID: 2312498
CIF file Formula: - Ge4 N4 O4 Sn -
Comments: 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 80(3) (2024)
Space group: P 63 m c
Cell volume: 281.6
Cell parameters: 5.876; 5.876; 9.418; 90; 90; 120;  

COD ID: 2312499
CIF file Formula: - Ge4.158 N4 O4 Sn0.842 -
Comments: 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 80(3) (2024)
Space group: P 63 m c
Cell volume: 276.51
Cell parameters: 5.839; 5.839; 9.365; 90; 90; 120;  

COD ID: 2312500
CIF file Formula: - Ge24 N24 O24 Sn6 -
Comments: 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 80(3) (2024)
Space group: R -3 m :H
Cell volume: 835.5
Cell parameters: 5.846; 5.846; 28.23; 90; 90; 120;  

COD ID: 2312501
CIF file Formula: - Ge24 N24 O24 Sn6 -
Comments: 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 80(3) (2024)
Space group: R -3 m :H
Cell volume: 835.5
Cell parameters: 5.846; 5.846; 28.23; 90; 90; 120;  

COD ID: 2312502
CIF file

HKL data

Formula: - Cs4 H5 O16 P S3 -
Comments: 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 80(3) (2024)
Space group: C 1 2/c 1
Cell volume: 1386
Cell parameters: 19.95; 7.856; 8.98; 90; 100.12; 90;  

COD ID: 2312533
CIF file

Original IUCr paper

Formula: - C9 H12 N6 O3 S3 -
Comments: Ben, Anna; Hoelm, Marta; Chęcińska, Lilianna Supramolecular architectures in multicomponent crystals of imidazole-based drugs and trithiocyanuric acid. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(4) (2024) 294-304
Space group: P 1 21/c 1
Cell volume: 1495.86
Cell parameters: 14.4914; 5.1924; 19.8863; 90; 91.457; 90;  

COD ID: 2312534
CIF file

Original IUCr paper

Formula: - C29 H31.32 Cl2 N7 O4.16 S3 -
Comments: Ben, Anna; Hoelm, Marta; Chęcińska, Lilianna Supramolecular architectures in multicomponent crystals of imidazole-based drugs and trithiocyanuric acid. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(4) (2024) 294-304
Space group: P 1 21/c 1
Cell volume: 3304.12
Cell parameters: 13.0291; 10.9297; 23.8029; 90; 102.897; 90;  

COD ID: 2312535
CIF file

Original IUCr paper

Formula: - C39 H31 Cl8 N7 O2 S3 -
Comments: Ben, Anna; Hoelm, Marta; Chęcińska, Lilianna Supramolecular architectures in multicomponent crystals of imidazole-based drugs and trithiocyanuric acid. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(4) (2024) 294-304
Space group: P -1
Cell volume: 2193.6
Cell parameters: 8.7764; 15.8851; 16.5229; 88.869; 80.569; 74.929;  

COD ID: 2312594
CIF file

Original IUCr paper

Formula: - Ca5.79 K0.72 Na1.71 O19 Si6 -
Comments: Kahlenberg, Volker; Krüger, Hannes; Garber, Sonja; Krüger, Biljana; Libowitzky, Eugen; Kröll, Stefanie; Hofer, Thomas S.; Gallmetzer, Josef M.; Purtscher, Felix R. S. K<sub>0.72</sub>Na<sub>1.71</sub>Ca<sub>5.79</sub>Si<sub>6</sub>O<sub>19</sub> - the first oligosilicate based on [Si<sub>6</sub>O<sub>19</sub>]-hexamers and its stability compared to cyclosilicates. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(5) (2024) 474-487
Space group: P 41 2 2
Cell volume: 1748.78
Cell parameters: 7.3659; 7.3659; 32.2318; 90; 90; 90;  

COD ID: 2312595
CIF file

HKL data

Formula: - C10 H53 N14.4 O37.6 V10 -
Comments: Chatkon, Aungkana; Haller, Kenneth J.; Haller, Joseph P. Substitutional/positional disorder of biguanide and guanylurea in the structure of a decavanadate complex [(Bg)(HV<sub>10</sub>O<sub>28</sub><sup>5-</sup>)]<sub>0.4</sub>[(HGU<sup>+</sup>)(V<sub>10</sub>O<sub>28</sub><sup>6-</sup>)]<sub>0.6</sub>(H<sub>2</sub>Met<sup>2+</sup>)<sub>2</sub>(H<sub>3</sub>O<sup>+</sup>)·8H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(5) (2024) 456-466
Space group: P 1 21/c 1
Cell volume: 2251.9
Cell parameters: 13.4299; 12.4338; 14.4959; 90; 111.519; 90;  

COD ID: 2312623
CIF file Formula: - C6 H28 Co N6 O8.5 V2 -
Comments: Vosegaard, Emilie Skytte; Mamakhel, Mohammad Aref Hasen; Parmar, Vijay Singh; Bertelsen, Andreas Dueholm; Iversen, Bo Brummerstedt Synthesis and characterization of an organic-inorganic hybrid crystal: 2[Co(en)<sub>3</sub>](V<sub>4</sub>O<sub>13</sub>)·4H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(5) (2024) 488-494
Space group: P -1
Cell volume: 851.36
Cell parameters: 8.6226; 8.9645; 12.8206; 81.491; 71.357; 65.064;  

COD ID: 2312624
CIF file

HKL data

Formula: - C Mo Si2 Y2 -
Comments: Vernière, Anne; Diop, Léopold V B; Sarr, Ibrahima; Schweitzer, Thierry; Malaman, Bernard Crystal structure of new quaternary intermetallic compounds R<sub>2</sub>MoSi<sub>2</sub>C (R = Y, Gd). Acta crystallographica Section B, Structural science, crystal engineering and materials 80(5) (2024) 504-508
Space group: P 4/m b m
Cell volume: 202.83
Cell parameters: 6.9525; 6.9525; 4.1962; 90; 90; 90;  

COD ID: 2312625
CIF file

HKL data

Formula: - C Gd2 Mo Si2 -
Comments: Vernière, Anne; Diop, Léopold V B; Sarr, Ibrahima; Schweitzer, Thierry; Malaman, Bernard Crystal structure of new quaternary intermetallic compounds R<sub>2</sub>MoSi<sub>2</sub>C (R = Y, Gd). Acta crystallographica Section B, Structural science, crystal engineering and materials 80(5) (2024) 504-508
Space group: P 4/m b m
Cell volume: 205.57
Cell parameters: 6.9945; 6.9945; 4.202; 90; 90; 90;  

COD ID: 2312626
CIF file Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 203.95
Cell parameters: 6.0132; 6.0132; 6.513; 90; 90; 120;  

COD ID: 2312627
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 191.029
Cell parameters: 5.947142; 5.947142; 6.236672; 90; 90; 120;  

COD ID: 2312628
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 191.249
Cell parameters: 5.948306; 5.948306; 6.241408; 90; 90; 120;  

COD ID: 2312629
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 191.576
Cell parameters: 5.94993; 5.94993; 6.248669; 90; 90; 120;  

COD ID: 2312630
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 191.986
Cell parameters: 5.951973; 5.951973; 6.257723; 90; 90; 120;  

COD ID: 2312631
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 192.451
Cell parameters: 5.954232; 5.954232; 6.268135; 90; 90; 120;  

COD ID: 2312632
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 192.959
Cell parameters: 5.956673; 5.956673; 6.279521; 90; 90; 120;  

COD ID: 2312633
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 193.501
Cell parameters: 5.959287; 5.959287; 6.291645; 90; 90; 120;  

COD ID: 2312634
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 194.069
Cell parameters: 5.961975; 5.961975; 6.304428; 90; 90; 120;  

COD ID: 2312635
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 194.672
Cell parameters: 5.964911; 5.964911; 6.317775; 90; 90; 120;  

COD ID: 2312636
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 195.294
Cell parameters: 5.967823; 5.967823; 6.331802; 90; 90; 120;  

COD ID: 2312637
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 195.945
Cell parameters: 5.970876; 5.970876; 6.346393; 90; 90; 120;  

COD ID: 2312638
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 196.616
Cell parameters: 5.973921; 5.973921; 6.361643; 90; 90; 120;  

COD ID: 2312639
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 197.312
Cell parameters: 5.977085; 5.977085; 6.377402; 90; 90; 120;  

COD ID: 2312640
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 198.032
Cell parameters: 5.98029; 5.98029; 6.393824; 90; 90; 120;  

COD ID: 2312641
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 198.768
Cell parameters: 5.983549; 5.983549; 6.410593; 90; 90; 120;  

COD ID: 2312642
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 199.535
Cell parameters: 5.986904; 5.986904; 6.42811; 90; 90; 120;  

COD ID: 2312643
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 200.369
Cell parameters: 5.990647; 5.990647; 6.446911; 90; 90; 120;  

COD ID: 2312644
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 201.237
Cell parameters: 5.994491; 5.994491; 6.46654; 90; 90; 120;  

COD ID: 2312645
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 202.144
Cell parameters: 5.998426; 5.998426; 6.487189; 90; 90; 120;  

COD ID: 2312646
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 203.094
Cell parameters: 6.0025; 6.0025; 6.50883; 90; 90; 120;  

COD ID: 2312647
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 204.099
Cell parameters: 6.006775; 6.006775; 6.53172; 90; 90; 120;  

COD ID: 2312648
CIF file

Original IUCr paper

Formula: - C Cl2 S -
Comments: Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic A comprehensive characterization of thiophosgene in the solid state Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 80(5) (2024) 495-503
Space group: P 63/m
Cell volume: 205.154
Cell parameters: 6.011293; 6.011293; 6.55562; 90; 90; 120;  

COD ID: 2312665
CIF file

HKL data

Original IUCr paper

Formula: - C10 H2 K2 N10 O4 -
Comments: Gaydamaka, A. A.; Rashchenko, S. V. Crystal structure of the incommensurate modulated high-pressure phase of the potassium guaninate monohydrate. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 676-681
Space group: C 1 2/c 1
Cell volume: 2667.9
Cell parameters: 34.434; 3.41097; 28.253; 90; 126.49; 90;  

COD ID: 2312698
CIF file

HKL data

Formula: - C5 H16 N2 O4 S2 -
Comments: Charkin, Dmitri O.; Banaru, Alexandru M.; Ivanov, Semen A.; Kireev, Vadim E.; Aksenov, Sergey M. A contribution to the crystal chemistry and topology of organic thiosulfates: bis(1-methylpiperazinium)·S<sub>2</sub>O<sub>3</sub>·H<sub>2</sub>O versus 1-methylpiperazinediium·S<sub>2</sub>O<sub>3</sub>·3H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 706-714
Space group: P 1 21/c 1
Cell volume: 1031.04
Cell parameters: 6.6308; 12.4415; 12.6936; 90; 100.074; 90;  

COD ID: 2312699
CIF file

HKL data

Formula: - C10 H32 N4 O6 S2 -
Comments: Charkin, Dmitri O.; Banaru, Alexandru M.; Ivanov, Semen A.; Kireev, Vadim E.; Aksenov, Sergey M. A contribution to the crystal chemistry and topology of organic thiosulfates: bis(1-methylpiperazinium)·S<sub>2</sub>O<sub>3</sub>·H<sub>2</sub>O versus 1-methylpiperazinediium·S<sub>2</sub>O<sub>3</sub>·3H<sub>2</sub>O. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 706-714
Space group: P 1 21/n 1
Cell volume: 1848.79
Cell parameters: 15.3506; 7.363; 16.3573; 90; 90.237; 90;  

COD ID: 2312700
CIF file

HKL data

Original IUCr paper

Formula: - C13 H12 F N3 O5 -
Comments: Kanagavel, Manimurugan; Balasubramanian, Sridhar; Nechipadappu, Sunil Kumar Variable stoichiometry and a salt-cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 793-806
Space group: P -1
Cell volume: 635.45
Cell parameters: 6.5047; 7.171; 13.9389; 81.8901; 81.0672; 86.6887;  

COD ID: 2312701
CIF file

HKL data

Original IUCr paper

Formula: - C11 H8 Cl F N4 O5 -
Comments: Kanagavel, Manimurugan; Balasubramanian, Sridhar; Nechipadappu, Sunil Kumar Variable stoichiometry and a salt-cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 793-806
Space group: P 1 2/n 1
Cell volume: 1365.8
Cell parameters: 9.632; 8.42; 16.959; 90; 96.781; 90;  

COD ID: 2312702
CIF file

HKL data

Original IUCr paper

Formula: - C11 H11 F2 N6 O3 -
Comments: Kanagavel, Manimurugan; Balasubramanian, Sridhar; Nechipadappu, Sunil Kumar Variable stoichiometry and a salt-cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 793-806
Space group: P -1
Cell volume: 665.19
Cell parameters: 7.2912; 9.3029; 10.7855; 110.756; 99.6967; 95.2484;  

COD ID: 2312703
CIF file

HKL data

Original IUCr paper

Formula: - C22 H22 F4 N12 O6 -
Comments: Kanagavel, Manimurugan; Balasubramanian, Sridhar; Nechipadappu, Sunil Kumar Variable stoichiometry and a salt-cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 793-806
Space group: P -1
Cell volume: 641.36
Cell parameters: 7.2415; 10.1036; 10.6423; 111.517; 99.093; 110.41;  

COD ID: 2312704
CIF file

HKL data

Original IUCr paper

Formula: - C24 H24 F3 N9 O7 -
Comments: Kanagavel, Manimurugan; Balasubramanian, Sridhar; Nechipadappu, Sunil Kumar Variable stoichiometry and a salt-cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 793-806
Space group: P 1 21/c 1
Cell volume: 2578
Cell parameters: 7.252; 36.579; 10.195; 90; 107.559; 90;  

COD ID: 2312705
CIF file

HKL data

Original IUCr paper

Formula: - C40 H32.6 Cu4 Mo4 N8 O16.3 -
Comments: Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 782-792
Space group: P 1 21/c 1
Cell volume: 4480.8
Cell parameters: 9.7136; 23.759; 19.9289; 90; 103.035; 90;  

COD ID: 2312706
CIF file

HKL data

Formula: - C10 H9 Cu2 Mo2 N2 O8.5 -
Comments: Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 782-792
Space group: P -1
Cell volume: 374.444
Cell parameters: 5.612; 5.7724; 12.4665; 95.99; 93.999; 110.227;  

COD ID: 2312707
CIF file

HKL data

Formula: - C40 H32.8 Cu4 Mo4 N8 O15.4 -
Comments: Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 782-792
Space group: P b c n
Cell volume: 2251.56
Cell parameters: 11.694; 9.0285; 21.3258; 90; 90; 90;  

COD ID: 2312708
CIF file Formula: - C40 H32 Cu4 Mo8 N8 O26 -
Comments: Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 782-792
Space group: P 1 21/c 1
Cell volume: 2671.95
Cell parameters: 10.86409; 11.244; 21.9304; 90; 94.1363; 90;  

COD ID: 2312709
CIF file

HKL data

Original IUCr paper

Formula: - C17 H23 I N2 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P 1 21 1
Cell volume: 795.65
Cell parameters: 5.76; 7.9063; 17.6186; 90; 97.412; 90;  

COD ID: 2312710
CIF file

HKL data

Original IUCr paper

Formula: - C18 H32 I2 N2 O3 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: C 1 2/c 1
Cell volume: 2282.99
Cell parameters: 24.6407; 8.3854; 11.0576; 90; 92.245; 90;  

COD ID: 2312711
CIF file

HKL data

Original IUCr paper

Formula: - C26 H50 I6 N2 O4 S4 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P -1
Cell volume: 2205
Cell parameters: 9.7562; 13.3158; 18.6498; 72.055; 86.424; 73.147;  

COD ID: 2312712
CIF file

HKL data

Original IUCr paper

Formula: - C22 H42 N2 O10 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P b c n
Cell volume: 2497.39
Cell parameters: 25.1134; 8.387; 11.857; 90; 90; 90;  

COD ID: 2312713
CIF file

HKL data

Original IUCr paper

Formula: - C22 H40 N2 O10 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P b c n
Cell volume: 2488.55
Cell parameters: 24.8529; 8.3869; 11.939; 90; 90; 90;  

COD ID: 2312714
CIF file

HKL data

Original IUCr paper

Formula: - C108 H224 N12 O70 V12 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P -1
Cell volume: 3861.35
Cell parameters: 9.0744; 17.4077; 25.1209; 92.859; 94.838; 101.799;  

COD ID: 2312715
CIF file

HKL data

Original IUCr paper

Formula: - C34 H48 N2 O14 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P 1 21/c 1
Cell volume: 1741.1
Cell parameters: 12.9176; 8.8157; 15.5173; 90; 99.836; 90;  

COD ID: 2312716
CIF file

HKL data

Original IUCr paper

Formula: - C60 H80 N4 O18 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P -1
Cell volume: 1413.25
Cell parameters: 10.0218; 11.3143; 13.6143; 92.431; 90.386; 113.564;  

COD ID: 2312717
CIF file

HKL data

Original IUCr paper

Formula: - C54 H54 N2 Na2 O18 -
Comments: Kanthapazham, Rajakumar; Osipov, Artyom A.; Zherebtsov, Dmitry A.; Efremov, Andrey N.; Nayfert, Sergey A.; Adonin, Sergey A.; Spiridonova, Dar'ya V.; Atapin, Sergey V. Structures of hexamethyl-[1,1'-biphenyl]-4,4'-diammonium salts. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 751-759
Space group: P -4 21 c
Cell volume: 10320.1
Cell parameters: 17.1314; 17.1314; 35.164; 90; 90; 90;  

COD ID: 2312718
CIF file

HKL data

Formula: - C15 H13.968 O8.984 -
Comments: Bibila Mayaya Bisseyou, Yvon; Wright, Jonathan; Jelsch, Christian Conformational disorder in quercetin dihydrate revealed from ultrahigh-resolution synchrotron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 766-781
Space group: P -1
Cell volume: 687.8
Cell parameters: 3.7244; 13.05; 14.982; 71.986; 83.86; 85.624;  

COD ID: 2312719
CIF file

Original IUCr paper

Formula: - Cu0 H O13 P3 Pb5 -
Comments: Xu, Mingyu; Wang, Haozhe; Vojvodin, Cameron; Yarava, Jayasubba Reddy; Wang, Tuo; Xie, Weiwei Polymorphism of Pb<sub>5</sub>(PO<sub>4</sub>)<sub>3</sub>OH<sub>δ</sub> within the LK-99 mixture. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 746-750
Space group: P n m a
Cell volume: 1304.92
Cell parameters: 13.5137; 10.2904; 9.3838; 90; 90; 90;  

COD ID: 2312726
CIF file

HKL data

Original IUCr paper

Formula: - Ni3 O8 V2 -
Comments: Aziz, Fiza; Paszkowicz, Wojciech; Minikayev, Roman; Martin, Christine; Kozlowski, Miroslaw; Teisseyre, Henryk Crystal structure of nickel orthovanadate (Ni<sub>3</sub>V<sub>2</sub>O<sub>8</sub>) at 299 (3) K and 1323 (8) K: an X-ray diffraction study. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 715-723
Space group: C m c e
Cell volume: 556.456
Cell parameters: 5.93384; 11.38318; 8.23818; 90; 90; 90;  

COD ID: 2312727
CIF file

HKL data

Formula: - Ni3 O8 V2 -
Comments: Aziz, Fiza; Paszkowicz, Wojciech; Minikayev, Roman; Martin, Christine; Kozlowski, Miroslaw; Teisseyre, Henryk Crystal structure of nickel orthovanadate (Ni<sub>3</sub>V<sub>2</sub>O<sub>8</sub>) at 299 (3) K and 1323 (8) K: an X-ray diffraction study. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 715-723
Space group: C m c e
Cell volume: 556.457
Cell parameters: 5.9324; 11.38492; 8.23893; 90; 90; 90;  

COD ID: 2312728
CIF file

HKL data

Formula: - Ni3 O8 V2 -
Comments: Aziz, Fiza; Paszkowicz, Wojciech; Minikayev, Roman; Martin, Christine; Kozlowski, Miroslaw; Teisseyre, Henryk Crystal structure of nickel orthovanadate (Ni<sub>3</sub>V<sub>2</sub>O<sub>8</sub>) at 299 (3) K and 1323 (8) K: an X-ray diffraction study. Acta crystallographica Section B, Structural science, crystal engineering and materials 80(6) (2024) 715-723
Space group: C m c e
Cell volume: 575.908
Cell parameters: 6.02077; 11.48838; 8.32611; 90; 90; 90;  


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