Crystallography Open Database

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Searching journal of publication like 'Acta crystallographica. Section C, Structural chemistry' volume of publication is 72

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2020472 CIF
HKL
C5 H4 N2 O3 SP 1 21/c 111.409; 15.552; 7.369
90; 97.599; 90
1296Seiler, Vanessa Kristina; Hützler, Wilhelm Maximilian; Bolte, Michael
Eight new crystal structures of 5-(hydroxymethyl)uracil, 5-carboxyuracil and 5-carboxy-2-thiouracil: insights into the hydrogen-bonded networks and the predominant conformations of the C5-bound residues
Acta Crystallographica Section C, 2016, 72, 379-388
2020473 CIF
HKL
Paper
C22 H21 N OP 1 21/c 124.8049; 10.7126; 12.1932
90; 95.929; 90
3222.7Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020474 CIF
HKL
C22 H21 N OP 21 21 217.5541; 14.7914; 15.4049
90; 90; 90
1721.28Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020475 CIF
HKL
C22 H21 N OP 1 21 17.2201; 7.8128; 14.7409
90; 93.69; 90
829.8Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020476 CIF
HKL
C18 H18 F N OP b c a7.5932; 7.5859; 51.01
90; 90; 90
2938.2Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020477 CIF
HKL
C15 H20 F N OR -3 :H25.119; 25.119; 11.2812
90; 90; 120
6164.4Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020478 CIF
HKL
C15 H20 F N OR -3 :H49.395; 49.395; 11.1802
90; 90; 120
23623.6Macías, Mario A.; Acosta, Lina M.; Sanabria, Carlos M.; Palma, Alirio; Roussel, Pascal; Gauthier, Gilles H.; Suescun, Leopoldo
Crystal structures of five new substituted tetrahydro-1-benzazepines with potential antiparasitic activity
Acta Crystallographica Section C, 2016, 72, 363-372
2020479 CIF
HKL
Paper
C36 H30 Cd N6 O7P -19.9863; 10.3722; 15.7502
91.755; 99.029; 95.042
1603.32Zhang, Zhi-Liang; Liu, Jia-Cheng
A new one-dimensional cadmium(II) coordination polymer incorporating 4-[4-(1<i>H</i>-imidazol-1-yl)phenyl]pyridine and 5-hydroxybenzene-1,3-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72, 389-392
2020480 CIF
HKL
Paper
C16 H17 N3 O6P 1 21/c 113.0087; 7.2092; 17.0024
90; 101.297; 90
1563.6Badour, Alec R.; Wisniewski, John A.; Mohanty, Dillip K.; Squattrito, Philip J.
Two <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2016, 72, 405-410
2020481 CIF
HKL
Paper
C16 H16 N2 O6 SC 1 2 121.26; 5.7264; 14.2762
90; 103.456; 90
1690.3Badour, Alec R.; Wisniewski, John A.; Mohanty, Dillip K.; Squattrito, Philip J.
Two <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2016, 72, 405-410
2020482 CIF
HKL
Paper
C19 H32 O5P 21 21 216.9028; 11.0334; 24.451
90; 90; 90
1862.2Faroque, Muhammad Umer; Yousuf, Sammer; Zafar, Salman; Choudhary, M. Iqbal; Ahmed, Maqsood
Transferred multipolar atom model for 10β,17β-dihydroxy-17α-methylestr-4-en-3-one dihydrate obtained from the biotransformation of methyloestrenolone
Acta Crystallographica Section C, 2016, 72, 398-404
2020483 CIF
HKL
C29 H41 Cl N2 Ni O8 P2P b c a11.7012; 16.2076; 35.285
90; 90; 90
6691.7García-Eleno, Marco A.; Quezada-Miriel, Magdalena; Reyes-Martínez, Reyna; Hernández-Ortega, Simón; Morales-Morales, David
A comparative study of the packing of two polymorphs of the nickel(II) pincer complex [2,6-bis(di-<i>tert</i>-butylphosphinoyl)-4-(3,5-dinitrobenzoyloxy)phenyl-κ^3^<i>P</i>,<i>C</i>^1^,<i>P</i>']chloridonickel(II)
Acta Crystallographica Section C, 2016, 72, 393-397
2020484 CIF
HKL
C29 H41 Cl N2 Ni O8 P2C 1 c 110.9248; 21.5339; 15.071
90; 101.851; 90
3469.9García-Eleno, Marco A.; Quezada-Miriel, Magdalena; Reyes-Martínez, Reyna; Hernández-Ortega, Simón; Morales-Morales, David
A comparative study of the packing of two polymorphs of the nickel(II) pincer complex [2,6-bis(di-<i>tert</i>-butylphosphinoyl)-4-(3,5-dinitrobenzoyloxy)phenyl-κ^3^<i>P</i>,<i>C</i>^1^,<i>P</i>']chloridonickel(II)
Acta Crystallographica Section C, 2016, 72, 393-397
2020485 CIF
HKL
C10 H9 N O S2P 1 21/n 18.4228; 7.9082; 16.2102
90; 97.152; 90
1071.35Balti, Monaem; Norberg, Bernadette; Efrit, Mohamed Lotfi; Lanners, Steve; Wouters, Johan
Conformation and tautomerism of methoxy-substituted 4-phenyl-4-thiazoline-2-thiones: a combined crystallographic and <i>ab initio</i> investigation
Acta Crystallographica Section C, 2016, 72, 421-425
2020486 CIF
HKL
C10 H9 N O S2P 1 21/n 14.7187; 12.0438; 17.8972
90; 93.752; 90
1014.94Balti, Monaem; Norberg, Bernadette; Efrit, Mohamed Lotfi; Lanners, Steve; Wouters, Johan
Conformation and tautomerism of methoxy-substituted 4-phenyl-4-thiazoline-2-thiones: a combined crystallographic and <i>ab initio</i> investigation
Acta Crystallographica Section C, 2016, 72, 421-425
2020487 CIF
HKL
Paper
C83 H109 O5 P3 S6 Si6 V2C 1 2/c 118.474; 25.4633; 19.3663
90; 100.036; 90
8970.7Wu, Hong-Ming; Chang, Ya-Ho; Su, Chia-Lin; Lee, Gene-Hsiang; Hsu, Hua-Fen
A non-oxo methanolate-bridged divanadium(IV) complex with tris(2-sulfanidylphenyl)phosphane ligands: synthesis, structural characterization and magnetic investigation
Acta Crystallographica Section C, 2016, 72, 416-420
2020488 CIF
HKL
Paper
C28 H40 Br2 Cd3 Cl4 N4 O4P -18.1048; 10.3928; 11.574
100.957; 96.178; 99.694
933.59Yahsi, Yasemin; Ozbek, Hatice; Aygun, Muhittin; Kara, Hulya
Crystal structure and photoluminescence properties of a new Cd^II^ coordination polymer <i>catena</i>-poly[bis[4-bromo-2-({[2-(pyrrolidin-1-yl)ethyl]imino}methyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]di-μ~3~-chlorido-di-μ~2~-chlorido-bis(methanol-κ<i>O</i>)tricadmium(II)]
Acta Crystallographica Section C, 2016, 72, 426-431
2020489 CIF
HKL
Paper
C5 H27 Al N2 O18 S2P -16.667; 12.16; 12.911
72.3; 81.03; 85.57
984.5Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020490 CIF
HKL
C10 H54 Co3 N4 O36 S4P -16.64; 11.71; 14.294
67.97; 81.57; 85.39
1018.8Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020491 CIF
HKL
C10 H54 Mg3 N4 O36 S4P -16.682; 11.807; 14.309
68.23; 82.13; 84.76
1037.5Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020492 CIF
HKL
C10 H26 N4 Ni O14 S2P -16.97; 7.913; 11.391
72.31; 89.57; 64.2
533.2Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020493 CIF
HKL
C10 H26 N4 O14 S2 ZnP -16.977; 7.929; 11.441
72.25; 89.53; 64.45
538.2Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
Acta Crystallographica Section C, 2016, 72, 432-441
2020494 CIF
HKL
Paper
C70 H46 Co2 N6 O10P -19.71; 10.891; 15.546
77.129; 74.474; 65.034
1425Liu, Runqiang; Zhao, Ning; Liu, Ping; An, Caixia; Lian, Zhaoxun
Enhanced third-order nonlinear optical properties determined in thin films using the Z-scan technique: bis(μ-4,4'-oxydibenzoato)bis[(4'-phenyl-2,2':6',2''-terpyridine)cobalt(II)]
Acta Crystallographica Section C, 2016, 72, 451-455
2020495 CIF
HKL
Paper
C48 H22 F18 P2 Pt S2P -110.3553; 10.5983; 12.4594
114.574; 104.4; 99.442
1147.61Bernès, Sylvain; Meléndez, Francisco J.; Torrens, Hugo
<i>Cis</i>‒<i>trans</i> isomerism in a square-planar platinum(II) complex bearing bulky fluorinated phosphane ligands
Acta Crystallographica Section C, 2016, 72, 268-273
2020496 CIF
HKL
Paper
C48 H22 F18 P2 Pt S2P b c a20.348; 19.511; 22.6059
90; 90; 90
8974.8Bernès, Sylvain; Meléndez, Francisco J.; Torrens, Hugo
<i>Cis</i>‒<i>trans</i> isomerism in a square-planar platinum(II) complex bearing bulky fluorinated phosphane ligands
Acta Crystallographica Section C, 2016, 72, 268-273
2020497 CIF
HKL
Paper
C22 H30 N2 O11 Zn2P -19.2372; 9.7244; 14.511
79.099; 83.298; 75.012
1233.2Liu, Yang; Feng, Yong-Lan; Fu, Wei-Wei
A two-dimensional zinc(II) coordination polymer based on mixed dimethyl succinate and bipyridine ligands: synthesis, structure, thermostability and luminescence properties
Acta Crystallographica Section C, 2016, 72, 308-312
2020498 CIF
HKL
Paper
C17 H20 N4 O5C 1 2/c 136.5539; 6.0781; 16.5167
90; 102.228; 90
3586.4Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.
Carboxylate‒phenolate tautomerism in 5-[(nitrophenyl)diazenyl]salicylate anions
Acta Crystallographica Section C, 2016, 72, 274-279
2020499 CIF
HKL
Paper
C17 H20 N4 O5P 1 21/c 113.4305; 6.782; 19.4498
90; 92.935; 90
1769.27Yatsenko, Alexandr V.; Paseshnichenko, Ksenia A.
Carboxylate‒phenolate tautomerism in 5-[(nitrophenyl)diazenyl]salicylate anions
Acta Crystallographica Section C, 2016, 72, 274-279
2020501 CIF
HKL
Paper
C17 H29 I2 N5P -15.2513; 13.9534; 16.0336
101.766; 93.23; 99.0746
1130.99Cebollada, Andrea; Vellé, Alba; Sanz Miguel, Pablo J.
Hirshfeld and DFT analysis of the N-heterocyclic carbene proligand methylenebis(N-butylimidazolium) as the acetonitrile-solvated diiodide salt
Acta Crystallographica Section C Structural Chemistry, 2016, 72
2020502 CIF
HKL
C10 H16 N5 O8 PP 21 21 217.715; 10.598; 35.481
90; 90; 90
2901.1Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020503 CIF
HKL
C10 H12.6 N5 O6.3 PP 21 21 217.786; 10.638; 29.887
90; 90; 90
2475.5Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020504 CIF
HKL
C10 H22 N5 O12 PP 21 21 216.691; 13.555; 19.863
90; 90; 90
1801.5Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020505 CIF
HKL
C10 H19 N5 Na O11 PP 21 21 217.206; 12.669; 18.754
90; 90; 90
1712.1Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020506 CIF
HKL
C10 H18 N4 Na O11 PP 21 21 216.652; 14.726; 17.208
90; 90; 90
1685.7Ślepokura, Katarzyna Anna
Purine 3':5'-cyclic nucleotides with the nucleobase in a <i>syn</i> orientation: cAMP, cGMP and cIMP
Acta Crystallographica Section C, 2016, 72
2020507 CIF
HKL
Paper
C6 H9 N3 OP -16.613; 7.018; 7.078
97.374; 104.521; 92.038
314.6Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
Two tautomeric forms of 2-amino-5,6-dimethylpyrimidin-4-one
Acta Crystallographica Section C, 2016, 72
2020508 CIF
HKL
Paper
C6 H9 N3 OP 1 21/c 17.188; 28.047; 13.3265
90; 101.414; 90
2633.5Hall, Victoria M.; Bertke, Jeffery A.; Swift, Jennifer A.
Two tautomeric forms of 2-amino-5,6-dimethylpyrimidin-4-one
Acta Crystallographica Section C, 2016, 72
2020514 CIF
HKL
C22 H21 Cd N5 O5P -18.5502; 9.2713; 15.363
88.48; 83.73; 76.65
1177.8Huang, Qiu-Ying; Lin, Xiao-Yi; Meng, Xiang-Ru
A new one-dimensional Cd^II^ coordination polymer with a two-dimensional layered structure incorporating 2-[(1<i>H</i>-imidazol-1-yl)methyl]-1<i>H</i>-benzimidazole and benzene-1,2-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72
2020515 CIF
Paper
C30 H52 O4C 1 2 123.908; 7.4853; 15.363
90; 91.89; 90
2747.8Xu, Yang-Rong; Yang, Jing-Jing; Liu, Juan; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of C24-epimeric 20(<i>R</i>)-ocotillol-type saponins
Acta Crystallographica Section C, 2016, 72
2020516 CIF
Paper
C30 H54 O5P 1 21 16.8503; 29.1839; 14.8014
90; 102.7; 90
2886.7Xu, Yang-Rong; Yang, Jing-Jing; Liu, Juan; Hou, Gui-Ge; Meng, Qing-Guo
Synthesis and crystal structures of C24-epimeric 20(<i>R</i>)-ocotillol-type saponins
Acta Crystallographica Section C, 2016, 72
2020517 CIF
HKL
Paper
C60 H72 Cl6 Co N12 O4P -18.909; 13.332; 14.92
93.598; 99.037; 104.678
1683.2Zhang, Yao; Li, Jie; Ren, Guoyu; Qin, Baofu; Ma, Haixia
Synthesis, crystal structure and antifungal activity of a divalent cobalt(II) complex with uniconazole
Acta Crystallographica Section C, 2016, 72
2020518 CIF
HKL
Paper
C26 H32 Cl2 N6 O2 ZnP -111.2504; 11.7298; 12.6588
71.518; 71.087; 65.76
1407.9DeStefano, Matthew R.; Geiger, David K.
Structural and spectroscopic characterization of two new blue luminescent pyridylbenzimidazole zinc(II) complexes
Acta Crystallographica Section C, 2016, 72
2020519 CIF
HKL
Paper
C26 H30 N4 O5 ZnP 1 21/n 116.0866; 8.715; 18.745
90; 94.193; 90
2620.9DeStefano, Matthew R.; Geiger, David K.
Structural and spectroscopic characterization of two new blue luminescent pyridylbenzimidazole zinc(II) complexes
Acta Crystallographica Section C, 2016, 72
2020521 CIF
HKL
Paper
C38 H33 B N O P2 RhP 1 21/c 113.9227; 12.35; 19.7966
90; 105.987; 90
3272.28Galding, M. R.; Virovets, A. V.; Kazakov, I. V.; Scheer, M.; Smirnov, S. N.; Timoshkin, A. Y.
Diminished electron density in the Vaska-type rhodium(I) complex <i>trans</i>-[Rh(NCBH~3~)(CO)(PPh~3~)~2~]
Acta Crystallographica Section C, 2016, 72, 514-517
2020522 CIF
HKL
Paper
C11 H13 N OP 1 21 16.2155; 8.7681; 8.9686
90; 106.14; 90
469.51Donkeng Dazie, Joel; Liška, Alan; Ludvík, Jiří; Fábry, Jan; Dušek, Michal
A study of the planarity of the pyrrolone fragment in 2-isopropyl-2,3-dihydro-1<i>H</i>-isoindol-1-one
Acta Crystallographica Section C, 2016, 72, 518-524
2020525 CIF
HKL
Paper
C18 H23 Cl2 Cu1.5 N6 O4C 1 2/c 118.5958; 16.6608; 14.2394
90; 93.692; 90
4402.5Bergamini, F. R. G.; Ribeiro, M. A.; Miranda, P. C. M. L.; Formiga, A. L. B.; Corbi, P. P.
A novel binuclear copper complex incorporating a nalidixic acid derivative displaying a one-dimensional coordination polymeric structure
Acta Crystallographica Section C, 2016, 72, 544-548
2020526 CIF
HKL
C18 H16 N5 O5.5 ZnC 1 2/c 121.612; 10.421; 19.246
90; 116.85; 90
3867.3Jian, Shou-Jun; Han, Qian-Qian; Yang, Huai-Xia; Meng, Xiang-Ru
A new three-dimensional zinc(II) coordination polymer involving 2-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-1<i>H</i>-benzimidazole and benzene-1,4-dicarboxylate ligands
Acta Crystallographica Section C, 2016, 72, 530-535
2020527 CIF
HKL
Paper
C28 H20 N4 O4 Pb2P -18.3754; 12.6354; 13.6686
112.213; 101.395; 95.781
1287.99Schwade, Vânia Denise; Faoro, Eliandro; Schulz Lang, Ernesto
Intermolecular Pb···N interactions in lead(II) dimers producing a supramolecular two-dimensional metal‒organic compound: bis[μ~2~-<i>N</i>'-(2-oxidobenzylidene)benzohydrazidato-κ^4^<i>O</i>:<i>O</i>,<i>N</i>',<i>O</i>']dilead(II)
Acta Crystallographica Section C, 2016, 72, 525-529
2020528 CIF
HKL
Paper
C9 H20 N2 O4 S4P 19.489; 9.8774; 15.079
71.429; 75.65; 89.369
1294.4Görbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Grønnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, Bård Edgar Vestheim
A phase transition from monoclinic <i>C</i>2 with <i>Z</i>' = 1 to triclinic <i>P</i>1 with <i>Z</i>' = 4 for the quasiracemate <small>L</small>-2-aminobutyric acid‒<small>D</small>-methionine (1/1)
Acta Crystallographica Section C, 2016, 72, 536-543
2020529 CIF
HKL
Paper
C9 H20 N2 O4 SC 1 2 129.1721; 4.7784; 9.8551
90; 103.145; 90
1337.77Görbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Grønnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, Bård Edgar Vestheim
A phase transition from monoclinic <i>C</i>2 with <i>Z</i>' = 1 to triclinic <i>P</i>1 with <i>Z</i>' = 4 for the quasiracemate <small>L</small>-2-aminobutyric acid‒<small>D</small>-methionine (1/1)
Acta Crystallographica Section C, 2016, 72, 536-543
2020530 CIF
HKL
Paper
C17 H16 N2 O4 SP 21 21 215.4764; 15.9117; 18.3228
90; 90; 90
1596.63Ukrainets, Igor V.; Shishkina, Svitlana V.; Baumer, Vyacheslav N.; Gorokhova, Olga V.; Petrushova, Lidiya A.; Sim, Galina
Two pseudo-enantiomeric forms of <i>N</i>-benzyl-4-hydroxy-1-methyl-2,2-dioxo-1<i>H</i>-2λ^6^,1-benzothiazine-3-carboxamide and their analgesic properties
Acta Crystallographica Section C, 2016, 72, 411-415

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