Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section B' volume of publication is 77

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2108851 CIF
HKL
Paper		C6 H3 Br3F d d 229.383; 79.163; 3.9713
90; 90; 90		9237.4Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej
Properties and interactions ‒ melting point of tribromobenzene isomers
Acta Crystallographica Section B, 2021, 77
2108852 CIF
HKL
Paper		C6 H3 Br3F d d 229.313; 78.645; 3.932
90; 90; 90		9064.5Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej
Properties and interactions ‒ melting point of tribromobenzene isomers
Acta Crystallographica Section B, 2021, 77
2108853 CIF
HKL
Paper		C6 H3 Br3P 21 21 214.06406; 13.5231; 14.1996
90; 90; 90		780.39Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej
Properties and interactions ‒ melting point of tribromobenzene isomers
Acta Crystallographica Section B, 2021, 77
2108854 CIF
HKL
Paper		C6 H3 Br3P 21 21 214.03673; 13.4739; 14.1499
90; 90; 90		769.62Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej
Properties and interactions ‒ melting point of tribromobenzene isomers
Acta Crystallographica Section B, 2021, 77
2108855 CIF
HKL
Paper		C6 H3 Br3P 21 21 214.00341; 13.4119; 14.0916
90; 90; 90		756.62Bujak, Maciej; Podsiadło, Marcin; Katrusiak, Andrzej
Properties and interactions ‒ melting point of tribromobenzene isomers
Acta Crystallographica Section B, 2021, 77
2108856 CIF
HKL		C32 Cl16 Cu N8C 1 2/m 117.5447; 25.9863; 3.76308
90; 95.336; 90		1708.2Gorelik, Tatiana E.; Habermehl, Stefan; Shubin, Aleksandr A.; Gruene, Tim; Yoshida, Kaname; Oleynikov, Peter; Kaiser, Ute; Schmidt, Martin U.
Crystal structure of copper perchlorophthalocyanine analysed by 3D electron diffraction
Acta Crystallographica Section B, 2021, 77
2108857 CIF
HKL
Paper		C10 H12 K2 N10 O4C 1 2/c 136.522; 3.82815; 28.639
90; 129.573; 90		3086.4Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108858 CIF
HKL		C10 H12 K2 N10 O4C 1 2/c 136.534; 3.84179; 28.656
90; 129.598; 90		3099.1Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108859 CIF
HKL		C10 H12 K2 N10 O4C 1 2/c 136.553; 3.85466; 28.687
90; 129.646; 90		3112.3Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108860 CIF
HKL		C10 H12 K2 N10 O4C 1 2/c 136.575; 3.86969; 28.723
90; 129.689; 90		3128.3Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108861 CIF
HKL		C10 H12 K2 N10 O4C 1 2/c 136.591; 3.88466; 28.759
90; 129.719; 90		3144.4Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108862 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.529; 11.6677; 11.1762
90; 101.608; 90		1344.91Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108863 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.5297; 11.67487; 11.1843
90; 101.584; 90		1346.91Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108864 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.5318; 11.68404; 11.1931
90; 101.563; 90		1349.4Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108865 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.534; 11.69648; 11.2042
90; 101.545; 90		1352.55Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108866 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.5373; 11.70992; 11.2176
90; 101.523; 90		1356.25Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108867 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.5404; 11.7241; 11.2296
90; 101.504; 90		1359.84Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108868 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.544; 11.7396; 11.2426
90; 101.476; 90		1363.81Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108869 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.5488; 11.7577; 11.2563
90; 101.456; 90		1368.3Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108870 CIF
HKL		C5 H17 N5 Na2 O8P 1 21/c 110.553; 11.7759; 11.2683
90; 101.41; 90		1372.65Gaydamaka, Anna A.; Arkhipov, Sergey G.; Boldyreva, Elena V.
A new guaninate hydrate K^+^·C~5~H~4~N~5~O^{-^}·H~2~O: crystal structure from 100 to 300K in a comparison with 2Na^+^·C~5~H~3~N~5~O^2{-^}·7H~2~O
Acta Crystallographica Section B, 2021, 77
2108871 CIF
HKL		C12 H42 Bi2 Cl12 N6C 1 2/c 127.8842; 10.19431; 12.45639
90; 102.911; 90		3451.34Bujak, Maciej
Understanding distortions of inorganic substructures in chloridobismuthates(III)
Acta Crystallographica Section B, 2021, 77
2108872 CIF
HKL		C12 H42 Bi2 Cl12 N6C 1 2/c 127.5447; 10.14187; 12.38379
90; 102.906; 90		3372.08Bujak, Maciej
Understanding distortions of inorganic substructures in chloridobismuthates(III)
Acta Crystallographica Section B, 2021, 77
2108873 CIF
HKL		C4 H14 Bi Cl5 N2P 21 21 217.60312; 12.50404; 13.63023
90; 90; 90		1295.82Bujak, Maciej
Understanding distortions of inorganic substructures in chloridobismuthates(III)
Acta Crystallographica Section B, 2021, 77
2108874 CIF
HKL		C15 H42 Bi2 Cl9 N9P 1 21/n 110.57031; 29.2063; 12.04367
90; 106.634; 90		3562.52Bujak, Maciej
Understanding distortions of inorganic substructures in chloridobismuthates(III)
Acta Crystallographica Section B, 2021, 77
2108875 CIF
HKL		C5 H14 Bi Cl4 N3P -17.7179; 10.566; 18.0362
95.585; 91.008; 110.965		1364.74Bujak, Maciej
Understanding distortions of inorganic substructures in chloridobismuthates(III)
Acta Crystallographica Section B, 2021, 77
2108876 CIF
HKL
Paper		C6 H9 N3 O2P 1 21 15.1651; 7.2324; 9.4957
90; 97.065; 90		352.03Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108877 CIF
HKL		C6 H9 N3 O2P 1 21 15.1656; 7.2761; 9.4978
90; 97.316; 90		354.07Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108878 CIF
HKL		C6 H9 N3 O2P 1 21 15.1854; 7.3998; 9.4976
90; 98.182; 90		360.72Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108879 CIF
HKL		C6 H9 N3 O2P 21 21 215.1498; 7.1902; 18.8503
90; 90; 90		697.99Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108880 CIF
HKL		C6 H9 N3 O2P 21 21 215.1521; 7.2228; 18.844
90; 90; 90		701.23Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108881 CIF
HKL		C6 H9 N3 O2P 21 21 215.169; 7.343; 18.8317
90; 90; 90		714.78Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108882 CIF
HKL		C6 H9 N3 O2P 1 21 15.1651; 7.2324; 9.4957
90; 97.065; 90		352.03Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108883 CIF
HKL		C6 H9 N3 O2P 1 21 15.1656; 7.2761; 9.4978
90; 97.316; 90		354.07Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108884 CIF
HKL		C6 H9 N3 O2P 1 21 15.1854; 7.3998; 9.4976
90; 98.182; 90		360.72Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108885 CIF
HKL		C6 H9 N3 O2P 21 21 215.1498; 7.1902; 18.8503
90; 90; 90		697.99Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108886 CIF
HKL		C6 H9 N3 O2P 21 21 215.1521; 7.2228; 18.844
90; 90; 90		701.23Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108887 CIF
HKL		C6 H9 N3 O2P 21 21 215.169; 7.343; 18.8317
90; 90; 90		714.78Novelli, Giulia; McMonagle, Charles J.; Kleemiss, Florian; Probert, Michael; Puschmann, Horst; Grabowsky, Simon; Maynard-Casely, Helen E.; McIntyre, Garry J.; Parsons, Simon
Accurate H-atom parameters for the two polymorphs of <small>L</small>-histidine at 5, 105 and 295K
Acta Crystallographica Section B, 2021, 77
2108888 CIF
HKL
Paper		C58 H62 Cl2 Cu4 N12 O34P 1 21/n 115.2568; 14.5155; 15.455
90; 92.086; 90		3420.4Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui
Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand
Acta Crystallographica Section B, 2021, 77
2108889 CIF
HKL		C62 H70 Cu4 N14 O32P 1 21/n 115.1553; 15.2135; 15.1959
90; 94.292; 90		3493.8Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui
Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand
Acta Crystallographica Section B, 2021, 77
2108890 CIF
HKL		C30 H31 Br2 Cl3 Cu2 N6 O12C 1 c 114.333; 17.1049; 16.3502
90; 101.859; 90		3922.93Li, Peng; Zhang, Ting; Li, Li-Li; Dong, Wen-Kui
Self-assembling of three rare structurally various homomultinuclear Cu^II^ complexes derived from a bis(salamo)-based multioxime ligand
Acta Crystallographica Section B, 2021, 77
2108891 CIFC6 H12 N3 O3A m a 212.1054; 13.5537; 5.20741
90; 90; 90		854.4Gallo, Gianpiero; Terban, Maxwell W.; Moudrakovski, Igor; Huber, Tatjana; Etter, Martin; Ernst, Martin; Hinrichsen, Bernd; Dinnebier, Robert E.
A previously unknown cyclic alkanolamine and molecular ranking using the pair distribution function
Acta Crystallographica Section B, 2021, 77, 986-995
2108892 CIFC7 H8 Cl N3 O4 S2P 1 21 17.3288; 8.5032; 9.9467
90; 111.29; 90		577.558Wojnarska, Joanna; Gryl, Marlena; Seidler, Tomasz; Stadnicka, Katarzyna Marta
Investigation of polar crystalline materials containing hydrochlorothiazide: electron density distribution and optical properties
Acta Crystallographica Section B, 2021, 77, 965-973
2108893 CIF
HKL		C12 H11 N O5P c a 2113.6648; 11.9321; 12.9678
90; 90; 90		2114.4Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood
Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis
Acta Crystallographica Section B, 2021, 77, 1035-1047
2108894 CIFC12 H11 N O5P c a 2113.6648; 11.9321; 12.9678
90; 90; 90		2114.4Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood
Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis
Acta Crystallographica Section B, 2021, 77, 1035-1047
2108895 CIFC12 H11 N O5P c a 2113.6648; 11.9321; 12.9678
90; 90; 90		2114.4Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood
Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis
Acta Crystallographica Section B, 2021, 77, 1035-1047
2108896 CIF
HKL		C12 H11 N O5P c a 2113.6648; 11.9321; 12.9678
90; 90; 90		2114.4Iqbal, Alia; Mehmood, Arshad; Noureen, Sajida; Lecomte, Claude; Ahmed, Maqsood
Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis
Acta Crystallographica Section B, 2021, 77, 1035-1047
2108897 CIF
HKL		C21 H29 N O2P 21 21 215.913; 15.305; 22.257
90; 90; 90		2014.2Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon
Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments
Acta Crystallographica Section B, 2021, 77, 892-905
2108898 CIF
HKL		C20 H29 N O2 SiP 21 21 216.816; 12.721; 23.613
90; 90; 90		2047.4Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon
Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments
Acta Crystallographica Section B, 2021, 77, 892-905
2108899 CIF
HKL		C19 H32 N4 O4P 21 21 219.3033; 14.8134; 29.664
90; 90; 90		4088.1Kleemiss, Florian; Puylaert, Pim; Duvinage, Daniel; Fugel, Malte; Sugimoto, Kunihisa; Beckmann, Jens; Grabowsky, Simon
Ibuprofen and sila-ibuprofen: polarization effects in the crystal and enzyme environments
Acta Crystallographica Section B, 2021, 77, 892-905
2108900 CIF
HKL
Paper		C4 H15 O15 RhC 1 2/c 116.2131; 13.0362; 6.3015
90; 99.572; 90		1313.32Garkul, Ilia; Zadesenets, Andrey; Filatov, Evgeny; Baidina, Iraida; Tkachev, Sergey; Samsonenko, Denis; Korenev, Sergey
Oxonium <i>trans</i>-bis(oxalato)rhodate and related sodium salts: a rare example of crystalline complex acid
Acta Crystallographica Section B, 2021, 77, 1048-1054

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