Crystallography Open Database

Result: there are 10615 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format

We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.

Searching journal of publication like 'Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials'

Blue left arrow Blue left arrow First | Blue left arrow Previous 200 | of 54 | Next 200 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
2021895 CIFO5 Rb2 Ti2C 1 2/m 111.3457; 3.8195; 6.9699
90; 100.359; 90
297.12Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte
The crystal structure of Rb2Ti2O5
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142
2021896 CIFO5 Rb2 Ti2C 1 2/m 111.337; 3.8244; 6.9946
90; 100.308; 90
298.37Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte
The crystal structure of Rb2Ti2O5
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142
2021897 CIFO5 Rb2 Ti2C 1 2/m 111.3419; 3.8198; 7.0103
90; 100.298; 90
298.82Federicci, Rémi; Baptiste, Benoit; Finocchi, Fabio; Popa, Florin; Brohan, Luc; Béneut, Keevin; Giura, Paola; Rousse, Gwenaëlle; Descamps-Mandine, Armel; Douillard, Thierry; Shukla, Abhay; Leridon, Brigitte
The crystal structure of Rb2Ti2O5
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1142
2021898 CIFC4 H11 F N5 O4 PC 1 2/c 120.6578; 8.922; 13.9144
90; 129.181; 90
1987.92Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021899 CIFC4 H11 F N5 O4 PC 1 2/c 120.6416; 8.9068; 13.9075
90; 129.118; 90
1983.77Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021900 CIFC4 H11 F N5 O4 PC 1 2/c 120.6339; 8.8975; 13.9054
90; 129.096; 90
1981.28Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021901 CIFC4 H11 F N5 O4 PC 1 2/c 120.6096; 8.8814; 13.8865
90; 129.047; 90
1974.05Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021902 CIFC4 H11 F N5 O4 PC 1 2/c 120.5877; 8.8673; 13.8912
90; 128.997; 90
1970.88Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021903 CIFC4 H11 F N5 O4 PC 1 2/c 120.5748; 8.853; 13.8869
90; 128.962; 90
1966.83Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021904 CIFC4 H11 F N5 O4 PC 1 2/c 120.5719; 8.8396; 13.9003
90; 128.924; 90
1966.53Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021905 CIFC4 H11 F N5 O4 PC 1 2/c 120.5473; 8.8249; 13.8851
90; 128.914; 90
1959.04Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1–x trioxofluorophosphate(2–)1–x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021906 CIFC4 H11 F N5 O4 PC 1 2/c 120.5418; 8.812; 13.8845
90; 128.89; 90
1956.23Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021907 CIFC4 H11 F N5 O4 PC 1 2/c 120.5237; 8.8033; 13.8813
90; 128.85; 90
1953.22Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021908 CIFC4 H11 F N5 O4 PC 1 2/c 120.5134; 8.7963; 13.8768
90; 128.806; 90
1951.27Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021909 CIFC4 H11 F N5 O4 PC 1 2/c 120.4891; 8.7848; 13.8632
90; 128.781; 90
1945.18Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021910 CIFC4 H11 F N5 O4 PC 1 2/c 120.5006; 8.7803; 13.8618
90; 128.797; 90
1944.64Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021911 CIFC4 H11 F N5 O4 PC 1 2/c 120.4756; 8.7798; 13.8428
90; 128.764; 90
1940.4Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021912 CIFC4 H11 F N5 O4 PC 1 2/c 120.463; 8.7767; 13.8368
90; 128.717; 90
1938.95Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021913 CIFC4 H11 F N5 O4 PC 1 2/c 120.4273; 8.7714; 13.7988
90; 128.623; 90
1931.62Matulková, Irena; Fábry, Jan; Němec, Ivan; Císařová, Ivana; Vaněk, Přemysl
Migrating hydrogen in 2,4,6-triaminopyrimidinium(1+) x hydrogen trioxofluorophosphate(−) x monohydrate/2,4,6-triaminopyrimidinium(2+)1‒x trioxofluorophosphate(2‒)1‒x monohydrate (0.0 < x < 0.73) with changing temperature
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2017, 73, 1114
2021914 CIF
Paper
C14 H14 N2 O4P -14.101; 11.892; 13.092
93.491; 97.769; 90.28
631.4Mishra, Risha; Pallepogu, Raghavaiah
Supramolecular heterosynthon assemblies of ortho-phenylenediamine with substituted aromatic carboxylic acids
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 32
2021915 CIFC13 H14 N2 O3P 1 21/c 14.7832; 11.6783; 21.859
90; 93.999; 90
1218.1Mishra, Risha; Pallepogu, Raghavaiah
Supramolecular heterosynthon assemblies of ortho-phenylenediamine with substituted aromatic carboxylic acids
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 32
2021916 CIF
Paper
C26 H28 N4 O6P -19.9374; 14.3212; 18.2929
72.196; 81.185; 82.068
2437.9Mishra, Risha; Pallepogu, Raghavaiah
Supramolecular heterosynthon assemblies of ortho-phenylenediamine with substituted aromatic carboxylic acids
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 32
2021917 CIF
Paper
C13 H13 N3 O4P 1 21 18.881; 6.0754; 11.995
90; 91.021; 90
647.1Mishra, Risha; Pallepogu, Raghavaiah
Supramolecular heterosynthon assemblies of ortho-phenylenediamine with substituted aromatic carboxylic acids
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 32
2021918 CIFC13 H12 N4 O6P 1 21/c 111.9565; 5.7973; 20.2355
90; 96.805; 90
1392.8Mishra, Risha; Pallepogu, Raghavaiah
Supramolecular heterosynthon assemblies of ortho-phenylenediamine with substituted aromatic carboxylic acids
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 32
2021919 CIFC12 H4 N4C 1 2/c 18.8782; 6.9117; 16.398
90; 98.288; 90
995.7Shukla, Rahul; Ruzié, Christian; Schweicher, Guillaume; Kennedy, Alan R.; Geerts, Yves H.; Chopra, Deepak; Chattopadhyay, Basab
Insight from electron density and energy framework analysis on the structural features of F x -TCNQ (x = 0, 2, 4) family of molecules
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2019, 75, 71
2021920 CIFC12 H2 F2 N4P 1 21/c 19.8303; 5.4679; 19.2479
90; 102.417; 90
1010.4Shukla, Rahul; Ruzié, Christian; Schweicher, Guillaume; Kennedy, Alan R.; Geerts, Yves H.; Chopra, Deepak; Chattopadhyay, Basab
Insight from electron density and energy framework analysis on the structural features of F x -TCNQ (x = 0, 2, 4) family of molecules
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2019, 75, 71
2021921 CIFC12 H2 F2 N4C 1 2/m 110.1713; 5.867; 8.8512
90; 106.969; 90
505.2Shukla, Rahul; Ruzié, Christian; Schweicher, Guillaume; Kennedy, Alan R.; Geerts, Yves H.; Chopra, Deepak; Chattopadhyay, Basab
Insight from electron density and energy framework analysis on the structural features of F x -TCNQ (x = 0, 2, 4) family of molecules
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2019, 75, 71
2021922 CIFC12 F4 N4P b c a9.1905; 8.0558; 14.564
90; 90; 90
1078.3Shukla, Rahul; Ruzié, Christian; Schweicher, Guillaume; Kennedy, Alan R.; Geerts, Yves H.; Chopra, Deepak; Chattopadhyay, Basab
Insight from electron density and energy framework analysis on the structural features of F x -TCNQ (x = 0, 2, 4) family of molecules
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2019, 75, 71
2021923 CIF
Paper
C3 H12 Bi Cl5 N2P c a 2119.8403; 6.3303; 19.0314
90; 90; 90
2390.25Abdel-Aal, Seham K.; Abdel-Rahman, Ahmed S.; Gamal, Wafia M.; Abdel-Kader, Mohamed; Ayoub, Hany S.; El-Sherif, Ashraf F.; Kandeel, M. F.; Bozhko, S.; Yakimov, E. E.; Yakimov, E. B.
Crystal structure, vibrational spectroscopy and optical properties of a one-dimensional organic–inorganic hybrid perovskite of [NH3CH2CH(NH3)CH2]BiCl5
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2019, 75, 880
2021924 CIFC18 H33 Eu5 O18I a -3 d28.7121; 28.7121; 28.7121
90; 90; 90
23669.8Abdallah, Amal; Ammar, Souad; Ban, Voraksmy; Sibille, Romain; Francois, Michel
Ab initio structure determination of [Eu5(C2H4O2)6(CH3CO2)3] n by X-ray powder diffraction
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2018, 74, 592
2022007 CIFC H3 O3P 1 21/c 16.092; 3.4919; 11.8481
90; 103.898; 90
244.66Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022008 CIFC2 H2 N4 O3P 1 21/c 19.3255; 5.4503; 9.04
90; 101.474; 90
450.29Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022009 CIFC33 H23 N OP 1 21/c 111.1055; 11.6712; 18.0627
90; 102.675; 90
2284.13Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022010 CIFC6 H14 N2 O7P 21 21 219.659; 9.672; 10.739
90; 90; 90
1003.26Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022011 CIFC7 H13 N O5P 21 21 219.902; 9.248; 10.166
90; 90; 90
930.9Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022012 CIFC41 H77.768 N2 O15.884P 21 21 2111.624; 16.748; 24.018
90; 90; 90
4675.8Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022013 CIFC12 H14 N2 O4P 21 21 215.2951; 8.1213; 27.256
90; 90; 90
1172.09Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022014 CIFC3 H6 N6 O6P b c a11.379; 10.5694; 13.1314
90; 90; 90
1579.3Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022015 CIFC3 H7 N O3P 1 21/a 110.7764; 9.1947; 4.7788
90; 106.87; 90
453.13Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022016 CIFC9 H14 N2 O2 SP -17.2934; 7.8145; 10.2181
87.055; 70.569; 72.898
524.22Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022017 CIFC14 H11 N O2P b c a11.827; 7.875; 23.504
90; 90; 90
2189.1Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022018 CIFC3 H7 N O2P 21 21 215.789; 5.9387; 12.2516
90; 90; 90
421.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022019 CIFC H3 O3P 1 21/c 16.0954; 3.4948; 11.8499
90; 103.939; 90
244.996Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022020 CIFC8 H16 N2 O3 SP 1 21/c 113.089; 5.329; 15.921
90; 108.57; 90
1052.7Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022021 CIFC7 H13 N O5P 21 21 219.866; 9.25; 10.149
90; 90; 90
926.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022022 CIFC H3 O3P 1 21/c 16.095; 3.4881; 11.8462
90; 103.842; 90
244.54Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022023 CIFC13 H19 N3 O6P 21 21 217.984; 9.535; 18.352
90; 90; 90
1397.1Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022024 CIFC16 H11 N O3P b c a12.925; 8.273; 23.954
90; 90; 90
2561.4Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022025 CIFC H4 N2 OP -4 21 m5.578; 5.578; 4.686
90; 90; 90
145.8Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022026 CIFC2 H5 N3 O SP 1 21/c 17.2359; 7.3713; 9.4768
90; 98.403; 90
500.05Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022027 CIFC6 H18 Cl2 N2 O4P 15.4491; 7.3962; 8.1337
79.382; 73.191; 69.544
292.75Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022028 CIFC7 H13 N O5P 21 21 219.853; 9.251; 10.145
90; 90; 90
924.7Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022029 CIFC7 H13 N O5P 21 21 219.884; 9.253; 10.155
90; 90; 90
928.7Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022030 CIFC5 H10 N2 O3P 21 21 217.4541; 9.4918; 9.7287
90; 90; 90
688.3Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022031 CIFC17 H21 N O4P 21 21 217.431; 13.769; 14.944
90; 90; 90
1529Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022032 CIFC H3 O3P 1 21/c 16.0988; 3.4954; 11.8455
90; 103.927; 90
245.096Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022033 CIFC H3 O3P 1 21/c 16.0939; 3.4965; 11.8441
90; 103.951; 90
244.92Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022034 CIFC3 H7 N O2P 21 21 216.6558; 7.8903; 8.6069
90; 90; 90
452.002Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022035 CIFC4 H7 N3 O2P 1 21/c 17.7161; 9.8337; 7.5131
90; 100.523; 90
560.49Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022036 CIFC22 H36 N6 O7P 21 21 2110.128; 12.486; 19.507
90; 90; 90
2466.8Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022037 CIFC5 H10 N2 O3P 21 21 217.4587; 9.4928; 9.725
90; 90; 90
688.57Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022038 CIFC16 H17 N O2P 1 21/n 18.5755; 10.1627; 14.2676
90; 95.249; 90
1238.21Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022039 CIFC3 H6 N6 O6P b c a11.4425; 10.6106; 13.1558
90; 90; 90
1597.27Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022040 CIFC11 H21 N3 O5P 21 21 216.825; 9.042; 21.728
90; 90; 90
1340.9Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022041 CIFC H3 O3P 1 21/c 16.0937; 3.4929; 11.8533
90; 103.948; 90
244.85Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022042 CIFC4 H9 N O3P 21 21 219.1735; 11.4736; 5.4171
90; 90; 90
570.166Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022043 CIFC7 H13 N O5P 21 21 219.854; 9.249; 10.144
90; 90; 90
924.52Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022044 CIFC5 H12 O5P 21 21 218.264; 8.901; 8.9223
90; 90; 90
656.3Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022045 CIFC13 H19 N O5P 21 21 217.235; 13.056; 14.415
90; 90; 90
1361.6Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022046 CIFC18 H28 N4 O5P 1 21 19.598; 8.939; 12.17
90; 108.75; 90
988.7Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022047 CIFC8 H18 N2 O4 SP b c a8.3222; 9.5441; 27.0123
90; 90; 90
2145.53Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022048 CIFC10 H10 N4 O2P 1 21/c 111.0104; 10.0398; 18.604
90; 97.32; 90
2039.77Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022049 CIFC H3 O3P 1 21/c 16.0889; 3.487; 11.8299
90; 103.93; 90
243.786Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022050 CIFC8 H8 N2 O2P -15.7913; 8.2458; 8.9223
116.823; 104.589; 91.602
362.99Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022051 CIFC5 H10 N2 O3P 21 21 217.4871; 9.4966; 9.7078
90; 90; 90
690.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022052 CIFC6 H6 N12 O12P 1 21/n 18.789; 12.474; 13.279
90; 106.578; 90
1395.3Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022053 CIFC6 H8 O2C 1 2/m 112.402; 6.47; 6.321
90; 93.69; 90
506.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022054 CIFC H3 O3P 1 21/c 16.0931; 3.4921; 11.8409
90; 103.842; 90
244.63Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022055 CIFC H3 O3P 1 21/c 16.0903; 3.4959; 11.8348
90; 103.917; 90
244.579Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022056 CIFC19 H14 N2 O2P 21 21 217.875; 9.892; 18.843
90; 90; 90
1467.9Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022057 CIFC H6 N O3 PP b c a8.977; 9.186; 10.003
90; 90; 90
824.9Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022058 CIFC5 H11 N4 O4 PP 1 21/n 15.8389; 19.3579; 8.0338
90; 97.203; 90
900.88Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022059 CIFC5 H10 N2 O3P 21 21 217.4583; 9.4892; 9.7301
90; 90; 90
688.6Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022060 CIFC H3 O3P 1 21/c 16.0988; 3.497; 11.8494
90; 103.922; 90
245.294Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022061 CIFC9 H6 O SP 21 21 214.0515; 10.1749; 17.6519
90; 90; 90
727.67Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022062 CIFC15 H26.269 N3 O7.634P 1 21 18.121; 9.299; 12.532
90; 91.21; 90
946.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022063 CIFC17 H30 F N3 O9P -19.507; 9.9649; 11.0233
94.182; 100.118; 91.432
1024.57Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022064 CIFC15 H29 N5 O6P 1 21 18.741; 9.42; 11.989
90; 95.49; 90
982.6Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022065 CIFC6 H16 Cl2 N2 O3P 1 21 18.6224; 7.0489; 9.8061
90; 106.486; 90
571.5Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022066 CIFC10 H14 N2 O5P 21 21 214.8462; 13.901; 16.316
90; 90; 90
1099.2Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022067 CIFC10 H10 N4 O2P 1 21/c 111.047; 10.129; 18.652
90; 97.223; 90
2070.5Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022068 CIFC H3 O3P 1 21/c 16.091; 3.4928; 11.8372
90; 103.901; 90
244.46Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022069 CIFC10 H10 N4 O2P 1 21/c 110.978; 10.006; 18.488
90; 97.223; 90
2014.7Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022070 CIFC5 H13 Cl N2 O2P 1 21 19.948; 7.9637; 4.9826
90; 83.13; 90
391.902Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022071 CIFC8 H17 N3 O5P 1 21 110.207; 4.78; 11.955
90; 101.39; 90
571.8Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022072 CIFC4 H4 N2 O SP -14.2427; 5.9648; 10.5801
105.736; 94.912; 91.927
256.32Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022073 CIFC1.25 H3 OI -46.0867; 6.0867; 8.4958
90; 90; 90
314.752Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022074 CIFC4 H3 N3 OP n a 2112.584; 9.699; 3.674
90; 90; 90
448.4Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022075 CIFC10 H10 N4 O2P 1 21/c 111.0299; 10.0921; 18.6365
90; 97.238; 90
2057.99Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022076 CIFC7 H6 O3P 1 21/c 14.8818; 11.2009; 11.2335
90; 92.621; 90
613.61Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022077 CIFC H3 O3P 1 21/c 16.0893; 3.4965; 11.8311
90; 103.883; 90
244.54Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022078 CIFC6 H16 N2 O6P 21 21 219.572; 10.039; 10.548
90; 90; 90
1013.6Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022079 CIFC2 H4 N4 O4P 1 21/n 16.922; 6.501; 11.262
90; 90.485; 90
506.77Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022080 CIFC13 H10 N2 O2P 1 21/c 113.659; 6.256; 12.862
90; 107; 90
1051Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022081 CIFC6 H15 Cl N2 O3P 21 21 215.4315; 9.8019; 17.3505
90; 90; 90
923.72Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022082 CIFC17 H27 N3 O6P 1 21 18.845; 9.057; 12.364
90; 94.56; 90
987.3Jha, Kunal Kumar; Gruza, Barbara; Kumar, Prashant; Chodkiewicz, Michal Leszek; Dominiak, Paulina Maria
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2020, 76
2022549 CIF
HKL
Paper
C19 H14 N3P 1 21/n 110.4887; 6.9632; 19.8755
90; 99.441; 90
1431.94Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022550 CIF
HKL
C19 H14 N3P 1 21/n 110.416; 6.8137; 19.69
90; 99.691; 90
1377.49Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022551 CIF
HKL
C19 H14 N3P 1 21/n 110.3807; 6.743; 19.605
90; 99.757; 90
1352.4Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022552 CIF
HKL
C19 H14 N3P 1 21/n 110.3374; 6.629; 19.466
90; 99.78; 90
1314.6Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022553 CIF
HKL
C19 H14 N3P 1 21/n 110.3045; 6.5805; 19.408
90; 99.823; 90
1296.74Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022554 CIF
HKL
C19 H14 N3P 1 21/n 110.276; 6.5173; 19.3323
90; 99.826; 90
1275.73Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022555 CIF
HKL
C19 H14 N3P 1 21/n 110.2411; 6.4507; 19.247
90; 99.913; 90
1252.5Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022556 CIF
HKL
C19 H14 N3P 1 21/n 110.2225; 6.4019; 19.203
90; 99.864; 90
1238.1Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022557 CIF
HKL
C19 H14 N3P 1 21/n 110.1831; 6.3399; 19.111
90; 99.868; 90
1215.5Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022558 CIF
HKL
C19 H14 N3P 1 21/n 110.1864; 6.3323; 19.118
90; 99.822; 90
1215.1Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022559 CIF
HKL
C19 H14 N3P 1 21/n 110.1302; 6.2215; 18.955
90; 99.899; 90
1176.85Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022560 CIF
HKL
C19 H14 N3P 1 21/n 110.0953; 6.1527; 18.8502
90; 99.934; 90
1153.29Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022561 CIF
HKL
C19 H14 N3P 1 21/n 110.0607; 6.0918; 18.733
90; 99.951; 90
1130.8Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022562 CIF
HKL
C19 H14 N3P 1 21/n 110.0326; 6.0553; 18.571
90; 100.029; 90
1111Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022563 CIF
HKL
C19 H14 N3P 1 21/n 110.0002; 6.0842; 18.352
90; 100.026; 90
1099.54Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022564 CIF
HKL
C19 H14 N3P 1 21/n 19.9832; 6.0752; 18.29
90; 100.005; 90
1092.4Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022565 CIF
HKL
C19 H14 N3P 1 21/n 19.9663; 6.0642; 18.252
90; 100.025; 90
1086.3Broadhurst, Edward T.; Wilson, Cameron J. G.; Zissimou, Georgia A.; Nudelman, Fabio; Constantinides, Christos P.; Koutentis, Panayiotis A.; Parsons, Simon
A first-order phase transition in Blatter's radical at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2022, 78
2022738 CIFC32 H24 Cl2 N8 O2P 1 21/c 116.5847; 12.3; 16.5847
90; 58.0757; 90
2871Gorelik, Tatiana E.; Bekő, Sàndor L; Teteruk, Jaroslav; Heyse, Winfried; Schmidt, Martin U.
Analysis of diffuse scattering in electron diffraction data for the crystal structure determination of Pigment Orange 13, C<sub>32</sub>H<sub>24</sub>Cl<sub>2</sub>N<sub>8</sub>O<sub>2</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 122-137
2022874 CIF
HKL
Cs I4P 1 21/c 110.2847; 8.9809; 11.21
90; 114.598; 90
941.46Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022875 CIF
HKL
Cs I4P 1 21/c 110.1323; 8.88899; 11.0453
90; 114.957; 90
901.91Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022876 CIF
HKL
Cs I4P 1 21/c 19.997; 8.8025; 10.9003
90; 115.28; 90
867.3Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022877 CIF
HKL
Cs I4P 1 21/c 19.934; 8.7538; 10.8339
90; 115.517; 90
850.2Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022878 CIF
HKL
Cs I4P 1 21/c 19.842; 8.7061; 10.7364
90; 115.68; 90
829.1Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022879 CIF
HKL
Cs I4P 1 21/c 19.788; 8.6889; 10.66
90; 115.607; 90
817.6Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022880 CIF
HKL
Cs I4P 1 21/c 19.7195; 8.6486; 10.59
90; 115.709; 90
802.07Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022881 CIF
HKL
Cs I4P 1 21/c 19.637; 8.6017; 10.4967
90; 115.788; 90
783.46Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022882 CIF
HKL
Cs I4P 1 21/c 19.6171; 8.5889; 10.4726
90; 115.81; 90
778.75Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022883 CIF
HKL
Cs I4P 1 21/c 19.5973; 8.5648; 10.4284
90; 115.854; 90
771.4Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022884 CIF
HKL
Cs I4P 1 21/c 19.4705; 8.5022; 10.2962
90; 115.934; 90
745.56Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022885 CIF
HKL
Cs I4P 1 21/c 19.4109; 8.4696; 10.2258
90; 115.972; 90
732.75Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022886 CIF
HKL
Cs I4P 1 21/c 19.3544; 8.4389; 10.1587
90; 115.998; 90
720.79Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022887 CIF
HKL
Cs I4P 1 21/c 19.2978; 8.4056; 10.0857
90; 116.015; 90
708.37Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Deformation of polyiodides in Cs2I8 crystals at high pressure
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 934-939
2022888 CIF
HKL
Paper
C7 H9 N O2P b c a13.70079; 7.16238; 25.8688
90; 90; 90
2538.51Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022889 CIF
HKL
Paper
C19 H21 N O6P 42/n :222.55; 22.55; 6.8267
90; 90; 90
3471.4Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022890 CIF
HKL
Paper
C32 H36 N2 O10P 1 21 16.9488; 9.982; 20.881
90; 90.927; 90
1448.2Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022891 CIF
HKL
Paper
C13 H15 N O4P b c a9.4231; 10.3938; 24.7171
90; 90; 90
2420.84Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022892 CIF
HKL
Paper
C13 H15 N O4P 1 21/c 112.867; 9.55; 10.487
90; 110.761; 90
1205Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022893 CIF
HKL
Paper
C10 H12 N O3P -16.83171; 7.09634; 10.01294
72.4243; 85.7351; 73.9285
444.659Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022894 CIF
HKL
Paper
C20 H24 N2 O6P 1 21/n 111.71471; 7.32566; 22.0867
90; 100.608; 90
1863.04Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022895 CIF
HKL
Paper
C13 H15 N O4P 1 21/n 17.13393; 18.2199; 9.1517
90; 95.4213; 90
1184.21Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022896 CIF
HKL
Paper
C20 H24 N2 O7P b c a6.9983; 18.4416; 28.896
90; 90; 90
3729.31Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022897 CIF
HKL
Paper
C20 H28 N2 O9P -17.9892; 10.197; 12.876
91.088; 93.874; 90.209
1046.4Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022898 CIF
HKL
Paper
C19 H21 N O8C 1 2/c 128.0626; 9.2719; 14.6075
90; 107.081; 90
3633.13Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022899 CIF
HKL
Paper
C19 H21 N O8P n a 2114.592; 9.3121; 26.795
90; 90; 90
3641Rajendrakumar, Satyasree; Surampudi Venkata Sai Durga, Anuja; Balasubramanian, Sridhar
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 946-964
2022900 CIF
HKL
Paper
B3 Ca H7 O9P -16.639; 8.3489; 6.4786
90.77; 101.94; 86.747
350.76Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022901 CIF
HKL
Paper
B3 Ca H7 O9P -16.55; 8.2005; 6.4337
90.367; 102.63; 86.784
336.68Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022902 CIF
HKL
Paper
B3 Ca H7 O9P -16.478; 8.0733; 6.3923
89.972; 103.3; 86.857
324.82Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022903 CIF
HKL
Paper
B3 Ca H7 O9P -16.465; 8.059; 6.388
89.922; 103.38; 86.859
323.3Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022904 CIF
HKL
Paper
B3 Ca H7 O9P -16.124; 7.6014; 6.8051
97.548; 107.416; 100.462
291.36Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022905 CIF
HKL
Paper
B3 Ca H7 O9P -16.095; 7.559; 6.7696
97.576; 107.579; 100.34
286.68Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022906 CIF
HKL
Paper
B3 Ca H7 O9P -16.071; 7.5224; 6.7393
97.606; 107.703; 100.254
282.75Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2022907 CIF
HKL
Paper
B3 Ca H7 O9P -16.05; 7.4908; 6.7136
97.629; 107.773; 100.211
279.42Comboni, Davide; Poreba, Tomasz; Pagliaro, Francesco; Battiston, Tommaso; Lotti, Paolo; Gatta, Giacomo Diego; Garbarino, Gaston; Hanfland, Michael
Crystal structure of the high-P polymorph of Ca2B6O6(OH)10·2(H2O) (meyerhofferite)
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2021, 77, 940-945
2023151 CIFC11 H8 N3 O5 ZnC 1 2/c 135.421; 9.928; 7.1277
90; 95.396; 90
2495.4Farahmand 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, 2024, 80, 208-218
2023223 CIF
HKL
Paper
C36 H38.6 Cl2 Cu N8 O11.3P -18.8398; 9.9196; 12.8239
97.633; 93.948; 107.385
1056.59Loukopoulos, 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, 2024, 80, 347-359
2023224 CIF
HKL
C38 H40 Cl2 Cu N8 O10P -19.3557; 9.838; 13.0238
75.71; 89.649; 69.657
1084.99Loukopoulos, 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, 2024, 80, 347-359
2023225 CIF
HKL
C40 H44 Cl2 Cu N8 O10P -19.3377; 9.7888; 12.987
103.114; 90.344; 109.408
1086.13Loukopoulos, 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, 2024, 80, 347-359
2023226 CIF
HKL
C42 H48 Cl2 Cu N8 O10P -19.1329; 10.0787; 13.0825
103.496; 94.562; 105.229
1117.04Loukopoulos, 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, 2024, 80, 347-359
2023227 CIF
HKL
C44 H52 Cl2 Cu N8 O10P -19.4157; 9.9855; 13.6726
106.181; 96.455; 106.527
1157.64Loukopoulos, 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, 2024, 80, 347-359
2023228 CIF
HKL
C42 H46 Cl2 Cu N10 O10P -19.1544; 9.8343; 14.2557
91.493; 107.948; 109.075
1142.38Loukopoulos, 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, 2024, 80, 347-359
2023229 CIF
HKL
C42 H44 Cl2 Cu N8 O10P -19.4814; 9.7136; 13.3146
69.117; 80.66; 68.833
1067.61Loukopoulos, 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, 2024, 80, 347-359
2023230 CIF
HKL
C44 H48 Cl2 Cu N8 O10P 1 21/n 19.0943; 25.0287; 10.0253
90; 107.509; 90
2176.2Loukopoulos, 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, 2024, 80, 347-359
2023231 CIF
HKL
Paper
C44 H48 Cl2 Cu N8 O12P -19.3679; 10.2347; 12.5311
79.661; 84.578; 73.249
1130.6Loukopoulos, 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, 2024, 80, 347-359
2023232 CIF
HKL
Paper
C44 H48 Cl2 Cu N8 O12P -110.0363; 10.1867; 11.9902
83.078; 82.032; 70.015
1137.37Loukopoulos, 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, 2024, 80, 347-359
2023233 CIF
HKL
Paper
C40 H42 Cl2 Cu N8 O9P -18.6577; 9.8396; 12.82
97.084; 93.897; 108.096
1023.61Loukopoulos, 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, 2024, 80, 347-359
2023289 CIF
HKL
Mn13 Zn126.044P 63/m m c12.9051; 12.9051; 57.6398
90; 90; 120
8313.3Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim
Synthesis and structural study of the partially disordered complex hexagonal phase δ1-MnZn9.7
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2024, 80
2023290 CIF
HKL
Mn13 Zn126.103P 63/m m c12.9085; 12.9085; 57.6528
90; 90; 120
8319.6Mondal, Amit; Pan, Rahul; Kuila, Sandip Kumar; Dey, Riju; Jana, Partha Pratim
Synthesis and structural study of the partially disordered complex hexagonal phase δ1-MnZn9.7
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2024, 80
2100000 CIF
Paper
C22 H12 Cl2 N6 O4P -14.2753; 8.311; 14.092
107.23; 93.53; 97.17
471.9Schmidt, Martin U.; Ermrich, Martin; Dinnebier, Robert E.
Determination of the structure of the violet pigment C~22~H~12~Cl~2~N~6~O~4~ from a non-indexed X-ray powder diagram
Acta Crystallographica Section B, 2005, 61, 37-45
2100001 CIF
Paper
C22 H12 Cl2 N6 O4P -14.3346; 8.4193; 13.9057
106.947; 92.9106; 95.118
481.934Schmidt, Martin U.; Ermrich, Martin; Dinnebier, Robert E.
Determination of the structure of the violet pigment C~22~H~12~Cl~2~N~6~O~4~ from a non-indexed X-ray powder diagram
Acta Crystallographica Section B, 2005, 61, 37-45
2100002 CIFCa F6 TbP 42/m5.2696; 5.2696; 7.7105
90; 90; 90
214.106Josse, Michaël; Dubois, Marc; El-Ghozzi, Malika; Cellier, Joël; Avignant, Daniel
Anti-KSbF~6~ structure of CaTbF~6~ and CdTbF~6~: a confirmation of the singular crystal chemistry of Tb^4+^ in fluorides
Acta Crystallographica, Section B: Structural Science, 2005, 61, 1-10
2100003 CIFCd F6 TbP 42/m5.1877; 5.1877; 7.69451
90; 90; 90
207.077Josse, Michaël; Dubois, Marc; El-Ghozzi, Malika; Cellier, Joël; Avignant, Daniel
Anti-KSbF~6~ structure of CaTbF~6~ and CdTbF~6~: a confirmation of the singular crystal chemistry of Tb^4+^ in fluorides
Acta Crystallographica, Section B: Structural Science, 2005, 61, 1-10
2100004 CIFCu0.63 O5 V2C 1 2/m 115.1; 3.6382; 10.0595
90; 105.585; 90
532.32Streltsov, Victor A.; Nakashima, Philip N. H.; Sobolev, Alexandre N.; Ozerov, Ruslan P.
Crystal structure study of a β'-copper vanadium bronze, Cu~x~V~2~O~5~ (x= 0.63), by X-ray and convergent beam electron diffraction
Acta Crystallographica, Section B: Structural Science, 2005, 61, 17-24
2100005 CIF
HKL
Paper
C6 H11 N O2P n 21 a10.8548; 9.752; 6.1152
90; 90; 90
647.331Asiloé J. Mora; Edward E. Ávila; Gerzon E. Delgado; Andrew N. Fitch; Michella Brunelli
Temperature effects on the hydrogen-bond patterns in 4-piperidinecarboxylic acid
Acta Crystallographica Section B, 2005, 61, 96-102
2100006 CIF
Paper
C6 H11 N O2P 21 21 2111.7537; 10.1013; 5.5787
90; 90; 90
662.35Asiloé J. Mora; Edward E. Ávila; Gerzon E. Delgado; Andrew N. Fitch; Michella Brunelli
Temperature effects on the hydrogen-bond patterns in 4-piperidinecarboxylic acid
Acta Crystallographica Section B, 2005, 61, 96-102
2100007 CIF
Paper
C16 H16 N4P n a 2119.499; 4.7884; 15.106
90; 90; 90
1410.4Eugenia V. Peresypkina; Mark B. Bushuev; Alexander V. Virovets; Victor P. Krivopalov; Ludmila G. Lavrenova; Stanislav V. Larionov
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100008 CIF
HKL
Paper
C16 H16 Cl2 Cu N4P 1 21/c 17.2156; 11.6522; 20.3956
90; 99.841; 90
1689.58Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100009 CIF
HKL
Paper
C16 H16 Cl2 Cu N4P b c a11.6899; 14.9843; 19.2115
90; 90; 90
3365.2Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100010 CIF
Paper
C16 H16 Cl2 Cu N4P 1 21/n 19.7652; 18.7631; 9.8115
90; 108.544; 90
1704.38Peresypkina, Eugenia V.; Bushuev, Mark B.; Virovets, Alexander V.; Krivopalov, Victor P.; Lavrenova, Ludmila G.; Larionov, Stanislav V.
Three differently coloured concomitant polymorphs: synthesis, structure and packing analysis of (4-(3',5'-dimethyl-1<i>H</i>-pyrazol-1'-yl)-6-methyl-2-phenylpyrimidine)dichlorocopper(II)
Acta Crystallographica Section B, 2005, 61, 164-173
2100011 CIF
HKL
Paper
C14 H10 Cr N2P 1 21/n 17.73; 12.0887; 11.1762
90; 91.683; 90
1043.92Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100012 CIF
HKL
Paper
C14 H13 Cr NP b c a12.9628; 12.0803; 13.61
90; 90; 90
2131.3Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100013 CIF
HKL
Paper
C14 H10 Cr F3 NP 1 21/c 19.7145; 7.8227; 15.74
90; 98.276; 90
1183.7Khrustalev, Victor N.; Vasil'kov, Alexander Yu.; Antipin, Mikhail Yu.
Substituent effects in bis(arene)chromium compounds containing a CN group in the aromatic ring
Acta Crystallographica Section B, 2005, 61, 304-311
2100014 CIFC H2 Cl2P b c n3.984; 7.863; 9.357
90; 90; 90
293.12Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak
In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane
Acta Crystallographica, Section B, 2005, 61, 595-600
2100015 CIFC H2 Cl2P b c n3.924; 7.793; 9.335
90; 90; 90
285.46Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak
In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane
Acta Crystallographica, Section B, 2005, 61, 595-600
2100016 CIF
Paper
C18 H26 OP -19.883; 11.579; 15.089
75.71; 73.51; 74.46
1567.67Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100017 CIF
Paper
C16 H18 Cl2 N6 O8 PdP -114.89; 7.968; 4.844
81.51; 84.22; 82.93
562.091Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100018 CIF
Paper
C48 H70 I N11 O13C 1 2 140.254; 12.53; 11.134
90; 98.48; 90
5554.4Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100019 CIF
Paper
C20 H44 O4 Sn2P -16.1757; 9.5349; 11.118
74.89; 81.36; 85.96
624.537Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100020 CIF
Paper
C30 H23 Cl3 N2 O P Re SP -110.369; 11.459; 13.787
91.08; 89.92; 106.98
1566.44Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100021 CIF
Paper
C32 H42 O6 Ti2C 1 2 123.2475; 7.9835; 23.097
90; 132.93; 90
3138.68Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100022 CIF
Paper
C22 H40 N6 Ni O2P -18.278; 8.8263; 9.1436
68.31; 70.64; 76
580.208Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100023 CIF
Paper
C28 H70 Cu3 F12 N8 O20 S4P -110.345; 10.72; 13.619
80.4; 71.41; 85.14
1410.67Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100024 CIF
Paper
C22.5 H28 N5 O1.5 S3P -110.1701; 12.2024; 12.395
75.76; 69.47; 73.75
1364.14Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100025 CIF
Paper
C44 H50 Cl2 N6 O8 PdP -17.9009; 9.3964; 15.9253
77.99; 77.34; 82.23
1123.32Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100026 CIF
Paper
C32 H64 B2 Ga2 O2P -19.209; 10.184; 10.503
69.55; 67.75; 77.23
849.734Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359
2100027 CIF
Paper
C90 H98 B2 N2 Ni P4P -113.581; 13.11; 13.483
118.45; 116.09; 80.22
1893.23Richard E. Marsh
Space group <i>P</i>1: an update
Acta Crystallographica Section B, 2005, 61, 359-359

Blue left arrow Blue left arrow First | Blue left arrow Previous 200 | of 54 | Next 200 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!