Crystallography Open Database

Result: there are 359 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 | archive of CIF files (ZIP)

Searching journal of publication like 'Acta Crystallographica Section C' volume of publication is 71

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 8 | Next 50 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
2019803 CIF
HKL
Paper
C4 H5 N3 OP c c n15.104; 15.1212; 9.2948
90; 90; 90
2122.8Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
The first polymorph in the family of nucleobases: a second form of cytosine
Acta Crystallographica Section C, 2015, 71
2019804 CIF
HKL
Paper
C8 H11 Cl2 Li O6P 1 21/n 17.8705; 4.9984; 30.9367
90; 90.343; 90
1217.03Smith, Graham
Low-dimensional coordination polymeric structures in alkali metal complex salts of the herbicide (2,4-dichlorophenoxy)acetic acid (2,4-D)
Acta Crystallographica Section C, 2015, 71
2019805 CIF
HKL
Paper
C8 H6 Cl2 O3.5 RbC 1 2/c 137.254; 4.3589; 13.2378
90; 103.231; 90
2092.6Smith, Graham
Low-dimensional coordination polymeric structures in alkali metal complex salts of the herbicide (2,4-dichlorophenoxy)acetic acid (2,4-D)
Acta Crystallographica Section C, 2015, 71
2019806 CIF
HKL
Paper
C8 H6 Cl2 Cs O3.5P c a 218.9877; 7.3441; 32.825
90; 90; 90
2166.67Smith, Graham
Low-dimensional coordination polymeric structures in alkali metal complex salts of the herbicide (2,4-dichlorophenoxy)acetic acid (2,4-D)
Acta Crystallographica Section C, 2015, 71
2019816 CIF
HKL
Paper
C13 H10 Cu N4 O3P -17.3171; 9.8692; 10.2416
68.401; 84.964; 70.617
648.2Wang, Jiang-Yun
Structural and spectropscopic studies of a three-dimensional hydrogen-bonded copper(II) complex: aqua[bis(pyridin-2-ylcarbonyl)amidato]cyanidocopper(II)
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 165
2019817 CIF
HKL
Paper
C22 H17 N O2P 21 21 216.2897; 17.0161; 15.3522
90; 90; 90
1643.09Boyarskaya, Dina; Avdontceva, Margarita; Chulkova, Tatiana
Synthesis and crystal structure of 2-isocyano-4-methylphenyl diphenylacetate: a rare case of an easily accessible odourless isocyanide
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 155
2019818 CIF
HKL
Paper
C31 H22 Cl4 Co P S4P 1 21/c 113.4605; 14.6661; 16.2419
90; 91.917; 90
3204.57Herich, Peter; Fronc, Marek; Kožíšek, Jozef
New isostructural transition metal complexes with a non-innocent dithiolate ligand
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 159
2019819 CIF
HKL
Paper
C54 H52 Cl4 Cu O2 P2 S6P 1 21/n 113.94737; 11.53304; 16.4799
90; 90.6983; 90
2650.69Herich, Peter; Fronc, Marek; Kožíšek, Jozef
New isostructural transition metal complexes with a non-innocent dithiolate ligand
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 159
2019820 CIF
HKL
Paper
C16 H18 Cu N4 O8P 1 21/n 18.344; 9.859; 11.273
90; 91.493; 90
927Zhong, Di-Chang; Guo, Hua-Bin; Deng, Ji-Hua; Lian, Ping; Luo, Xu-Zhong
A two-dimensional copper(II) coordination polymer based on 2-propyl-1H-imidazole-4,5-dicarboxylic acid
Acta Crystallographica Section C Structural Chemistry, 2015, 71, 152
2019840 CIF
HKL
Paper
C16 H12 Br2 Cs Fe N6 O2 S2P 1 21/c 120.25; 12.0868; 9.0389
90; 90.337; 90
2212.3Powell, Robyn Elizabeth; Schwalbe, Carl H.; Tizzard, Graham J.; Koningsbruggen, Petra J. van
Caesium bis(5-bromosalicylaldehyde thiosemicarbazonato-κ3O,N,S)ferrate(III): supramolecular arrangement of low-spin FeIIIcomplex anions mediated by Cs+cations
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019841 CIF
HKL
Paper
C14 H12 N2 O2P -18.4147; 9.1827; 15.2673
87.174; 89.87; 83.631
1170.99Vazquez-Vuelvas, Oscar F.; Hernández-Madrigal, Julia V.; Pineda-Contreras, Armando; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David
Exoconformers ofN-(pyridin-2-yl)- andN-(pyridin-3-yl)norbornene-5,6-dicarboximide crystals
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019842 CIF
HKL
Paper
C14 H12 N2 O2C 1 c 123.24; 9.4869; 10.7258
90; 105.82; 90
2275.2Vazquez-Vuelvas, Oscar F.; Hernández-Madrigal, Julia V.; Pineda-Contreras, Armando; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David
Exoconformers ofN-(pyridin-2-yl)- andN-(pyridin-3-yl)norbornene-5,6-dicarboximide crystals
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019843 CIF
HKL
Paper
C20 H18 N O2 PP 1 21/c 118.035; 5.9874; 16.236
90; 105.133; 90
1692.4Majer, Sean H.; Tanski, Joseph M.
Synthesis and crystal structure of a novel prochiral ketoimine: (E)-acetophenoneO-diphenylphosphoryl oxime
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019865 CIF
HKL
Paper
C39 H48 Cl6 O17P 21 21 2114.7029; 16.6256; 18.8428
90; 90; 90
4606Wang, Li; Li, Ya-jun; Li, Zheng-wei
Towards validating new enzymatic routes for synthetic conversion: 7,10-bis-<i>O</i>-(2,2,2-trichloroethoxycarbonyl)-10-deacetyl baccatin III‒ethyl acetate‒water (1/1/1)
Acta Crystallographica Section C, 2015, 71
2019866 CIF
HKL
Paper
C63 H63 Ni O9 P3C 1 2/c 121.5898; 12.3292; 43.403
90; 104.129; 90
11203.7Kampmann, Sven S.; Skelton, Brian W.; Wild, Duncan A.; Koutsantonis, George A.; Stewart, Scott G.
Tris(tri-<i>o</i>-tolyl phosphite-κ<i>P</i>)nickel: a coordinatively unsaturated nickel(0) complex
Acta Crystallographica Section C, 2015, 71
2019867 CIF
HKL
Paper
C28 H56 Mn12 N8 O60I 41/a15.7293; 15.7293; 27.901
90; 90; 90
6903Thuijs, Annaliese E.; Christou, George; Abboud, Khalil A.
[Mn~12~O~12~(O~2~CMe)~12~(NO~3~)~4~(H~2~O)~4~]: facile synthesis of a new type of Mn~12~ complex
Acta Crystallographica Section C, 2015, 71
2019868 CIF
HKL
Paper
C35 H31 N SiP 1 21/c 112.8008; 9.5323; 22.906
90; 92.817; 90
2791.6Lee, Ah-Rang; Han, Won-Sik
Incorporating two different chromophores onto a silicon atom: the crystal structure and photophysical properties of 9-{4-[(9,9-dimethyl-9<i>H</i>-fluoren-2-yl)dimethylsilyl]phenyl}-9<i>H</i>-carbazole
Acta Crystallographica Section C, 2015, 71
2019869 CIF
HKL
Paper
C23 H28 N2 O6P 1 21 111.2986; 4.8997; 21.6179
90; 102.636; 90
1167.78Nicholas, Sumesh
The peptide NCbz-Val-Tyr-OMe and aromatic π‒π interactions
Acta Crystallographica Section C, 2015, 71
2019870 CIF
HKL
Paper
C9 H15 N O3 SP 21 21 216.8001; 8.8015; 17.4805
90; 90; 90
1046.23Bojarska, Joanna; Maniukiewicz, Waldemar; Fruziński, Andrzej; Sieroń, Lesław; Remko, Milan
Captopril and its dimer captopril disulfide: comparative structural and conformational studies
Acta Crystallographica Section C, 2015, 71
2019871 CIF
HKL
Paper
C18 H28 N2 O6 S2P 1 21 16.6678; 11.068; 14.4219
90; 91.925; 90
1063.72Bojarska, Joanna; Maniukiewicz, Waldemar; Fruziński, Andrzej; Sieroń, Lesław; Remko, Milan
Captopril and its dimer captopril disulfide: comparative structural and conformational studies
Acta Crystallographica Section C, 2015, 71
2019872 CIF
HKL
Paper
C12 H18 N2 O3P 1 21/c 117.9322; 10.4961; 13.2006
90; 95.896; 90
2471.45Gelbrich, Thomas; Meischberger, Isabella; Griesser, Ulrich J.
Two polymorphs of 5-cyclohexyl-5-ethylbarbituric acid and their packing relationships with other barbiturates
Acta Crystallographica Section C, 2015, 71
2019873 CIF
HKL
Paper
C12 H18 N2 O3C 1 2/c 112.5071; 21.0741; 10.331
90; 116.989; 90
2426.5Gelbrich, Thomas; Meischberger, Isabella; Griesser, Ulrich J.
Two polymorphs of 5-cyclohexyl-5-ethylbarbituric acid and their packing relationships with other barbiturates
Acta Crystallographica Section C, 2015, 71
2019874 CIF
HKL
C4 H16 Mg2 N18 O7P 21 21 210.193; 23.924; 7.284
90; 90; 90
1776.3Bensegueni, Mohamed Abdellatif; Cherouana, Aouatef; Dahaoui, Slimane
Syntheses and crystal structures of two magnesium‒tetrazole compounds in salt and polymeric forms
Acta Crystallographica Section C, 2015, 71
2019875 CIF
HKL
C10 H18 Mg N12 O6P -17.868; 8.268; 8.608
63.59; 68.56; 80.47
466.8Bensegueni, Mohamed Abdellatif; Cherouana, Aouatef; Dahaoui, Slimane
Syntheses and crystal structures of two magnesium‒tetrazole compounds in salt and polymeric forms
Acta Crystallographica Section C, 2015, 71
2019876 CIF
HKL
C19 H30 N8 O3 SC 1 2/c 113.9475; 8.1618; 40.9157
90; 98.148; 90
4610.7Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019877 CIF
HKL
C9 H12 N6 O SP n m a6.9996; 19.223; 17.143
90; 90; 90
2306.6Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019878 CIF
HKL
C22 H36 N10 O4 S2P -18.2095; 12.8069; 14.3391
89.914; 76.23; 83.418
1454.1Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019879 CIF
HKL
C10 H16 N5 O2 SC 1 2/c 114.9786; 8.201; 22.568
90; 99.899; 90
2731Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019880 CIF
HKL
C20 H33 N11 O4 S2P 1 21/m 18.268; 6.6; 25.043
90; 98.887; 90
1350.16Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019881 CIF
HKL
C12 H19 N7 O3 SP 1 21/n 17.3559; 30.068; 8.1263
90; 115.534; 90
1621.8Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019882 CIF
HKL
C11 H18 N6 O3 S2P 1 21/c 18.252; 23.9532; 8.2133
90; 102.496; 90
1585Hützler, Wilhelm Maximilian; Egert, Ernst
Cocrystals of 6-methyl-2-thiouracil: presence of the acceptor‒donor‒acceptor/donor‒acceptor‒donor synthon
Acta Crystallographica Section C, 2015, 71
2019883 CIF
HKL
Paper
C24 H51 O PP 1 21/c 115.0889; 5.2252; 33.5535
90; 99.449; 90
2609.55Doan-Nguyen, Vicky V. T.; Carroll, Patrick J.; Murray, Christopher B.
Structure determination and modeling of monoclinic trioctylphosphine oxide
Acta Crystallographica Section C, 2015, 71
2019886 CIF
HKL
Paper
C12 H11 Cl N2 O8P 1 2/c 110.252; 5.8362; 12.656
90; 106.29; 90
726.8Wang, Bi-Qin; Yan, Hai-Biao; Huang, Zheng-Qing; Zhang, Yun-Hua; Sun, Jing
Reversible phase transition of 2-carboxypyridinium perchlorate‒pyridinium-2-carboxylate (1/1)
Acta Crystallographica Section C, 2015, 71
2019887 CIF
HKL
Paper
C12 H11 Cl N2 O8C 1 2/c 120.904; 11.953; 12.018
90; 108.18; 90
2853Wang, Bi-Qin; Yan, Hai-Biao; Huang, Zheng-Qing; Zhang, Yun-Hua; Sun, Jing
Reversible phase transition of 2-carboxypyridinium perchlorate‒pyridinium-2-carboxylate (1/1)
Acta Crystallographica Section C, 2015, 71
2019888 CIF
HKL
Paper
C20 H21 N O4P 1 21/n 110.516; 14.796; 10.62
90; 101.986; 90
1616.4Pingali, Subramanya; Donahue, James P.; Payton-Stewart, Florastina
Tetrahydroberberine, a pharmacologically active naturally occurring alkaloid
Acta Crystallographica Section C, 2015, 71
2019889 CIF
HKL
Paper
C5 H9 Cl2 Cu N O2P -16.6312; 9.717; 12.837
76.136; 89.521; 81.162
793.2Lamberts, Kevin; Şerb, Mihaela-Diana; Englert, Ulli
Unexpected proline coordination in the copper chain polymer [Cu(μ-Cl)~2~(μ-<small>DL</small>-proline-κ^2^<i>O</i>:<i>O</i>')]^1^~{\ιnfty ~}
Acta Crystallographica Section C, 2015, 71
2019890 CIF
HKL
Paper
C12 H16 Cl N O3P 21 21 216.90225; 7.13; 25.4692
90; 90; 90
1253.42Cameron, T. Stanley; Grossert, J. Stuart; Maheux, Chad R.; Alarcon, Idralyn Q.; Copeland, Catherine R.; Linden, Anthony
Inversion twinning in a second polymorph of the hydrochloride salt of the recreational drug ethylone
Acta Crystallographica Section C, 2015, 71
2019891 CIF
HKL
Paper
C14 H33 N5 S2P 1 21/c 110.1149; 8.1266; 23.1765
90; 91.889; 90
1904.07Guo, Hao; Wu, Jinfeng
N—H...S and C—H...S hydrogen bonds in two tetraalkylammonium dithiobiurea(1‒) inclusion compounds
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019892 CIF
HKL
C18 H41 N5 S2P -19.4151; 9.6835; 13.4189
77.679; 89.246; 77.692
1167.1Guo, Hao; Wu, Jinfeng
N—H...S and C—H...S hydrogen bonds in two tetraalkylammonium dithiobiurea(1‒) inclusion compounds
Acta Crystallographica Section C Structural Chemistry, 2015, 71
2019893 CIF
HKL
Paper
C26 H29 Cl N4 Ni O7P -110.8804; 11.4335; 12.5387
66.319; 78.224; 69.035
1330.59Farkašová, Nela; Černák, Juraj; Falvello, Larry R.; Orendáč, Martin; Boča, Roman
Synthesis, crystal structure and magnetic properties of (acetato-κ^2^<i>O</i>,<i>O</i>')bis(5,5'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')nickel(II) perchlorate monohydrate
Acta Crystallographica Section C, 2015, 71
2019894 CIF
HKL
Paper
C24 H24 Ag As N O4 PP 1 21/n 114.751; 10.014; 16.418
90; 106.13; 90
2329.7Xiao, Zu-Ping; Wen, Meng; Wang, Chun-Ya; Huang, Xi-He
A two-dimensional silver(I) coordination polymer constructed from 4-aminophenylarsonate and triphenylphosphane: poly[[(μ~3~-4-aminophenylarsonato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>)(triphenylphosphane-κ<i>P</i>)silver(I)] monohydrate]
Acta Crystallographica Section C, 2015, 71
2019895 CIF
Paper
C23 H30 N6 O6P 1 21 16.2201; 22.964; 16.8626
90; 92.879; 90
2405.6Rivera, Augusto; Uribe, Juan Manuel; Ríos-Motta, Jaime; Osorio, Hector Jairo; Bolte, Michael
Evidence for stereoelectronic effects in the N—C—N group of 8,10,12-triaza-1-azoniatetracyclo[8.3.1.1^8,12^.0^2,7^]pentadecane 4-nitrophenolate 4-nitrophenol monosolvate from the protonation of aminal (2<i>R</i>,7<i>R</i>)-1,8,10,12-tetraazatetracyclo[8.3.1.1^8,12^.0^2,7^]pentadecane: X-ray and natural bond orbital analysis
Acta Crystallographica Section C, 2015, 71
2019896 CIF
HKL
Paper
C16 H15.5 Cd2 N12 O5.75P 6113.3384; 13.3384; 24.957
90; 90; 120
3845.3Shi, Wei; Liu, Jian-Jun; Ou, Xiang-Ping; Huang, Chang-Cang
A three-dimensional cadmium(II) coordination polymer with unequal homochiral double-stranded concentric helical chains
Acta Crystallographica Section C, 2015, 71
2019897 CIF
HKL
Paper
C9 H13 N3 O4P b c m4.1667; 12.6657; 20.3238
90; 90; 90
1072.57Odiase, Isaac; Nicholson, Catherine E.; Ahmad, Ruksanna; Cooper, Jerry; Yufit, Dmitry S.; Cooper, Sharon J.
Three cocrystals and a cocrystal salt of pyrimidin-2-amine and glutaric acid
Acta Crystallographica Section C, 2015, 71
2019898 CIF
HKL
C9 H13 N3 O4P -16.0184; 7.4714; 12.0911
84.371; 89.906; 76.094
525.07Odiase, Isaac; Nicholson, Catherine E.; Ahmad, Ruksanna; Cooper, Jerry; Yufit, Dmitry S.; Cooper, Sharon J.
Three cocrystals and a cocrystal salt of pyrimidin-2-amine and glutaric acid
Acta Crystallographica Section C, 2015, 71
2019899 CIF
HKL
C13 H18 N6 O4P 1 21/n 110.2625; 15.0558; 11.1755
90; 113.032; 90
1589.08Odiase, Isaac; Nicholson, Catherine E.; Ahmad, Ruksanna; Cooper, Jerry; Yufit, Dmitry S.; Cooper, Sharon J.
Three cocrystals and a cocrystal salt of pyrimidin-2-amine and glutaric acid
Acta Crystallographica Section C, 2015, 71
2019900 CIF
HKL
C23 H34 N6 O12P -15.4848; 11.1944; 22.9123
91.781; 92.371; 103.011
1368.32Odiase, Isaac; Nicholson, Catherine E.; Ahmad, Ruksanna; Cooper, Jerry; Yufit, Dmitry S.; Cooper, Sharon J.
Three cocrystals and a cocrystal salt of pyrimidin-2-amine and glutaric acid
Acta Crystallographica Section C, 2015, 71
2019901 CIF
HKL
C16 H27 Au Cl3 N8 O1.5 S4P -18.153; 9.866; 9.969
90.179; 96.892; 109.15
751.3Lynch, Will E.; Padgett, Clifford W.; Quillian, Brandon; Haddock, John
A square-planar hydrated cationic tetrakis(methimazole)gold(III) complex
Acta Crystallographica Section C, 2015, 71
2019902 CIF
HKL
Paper
C15 H22 O3P 1 21 18.2892; 8.3401; 11.0225
90; 108.75; 90
721.58Paz, Cristian; Burgos, Viviana; Suarez, Sebastián; Baggio, Ricardo
A monoclinic form of dendocarbin A: a borderline case of one-dimensional isostructural polymorphism
Acta Crystallographica Section C, 2015, 71
2019903 CIF
HKL
Paper
C36 H46 N2 O14 Y2P -18.5138; 10.5593; 12.2415
66.699; 74.443; 85.953
972.9Atria, Ana María; Garland, Maria Teresa; Baggio, Ricardo
Three isotypic polymeric complexes with rare earth cations, but-2-enoate anions and 4,4'-(ethane-1,2-diyl)dipyridine and 4,4'-(ethene-1,2-diyl)dipyridine bridging ligands
Acta Crystallographica Section C, 2015, 71

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 8 | Next 50 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!