Crystallography Open Database

Result: there are 547 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 E' volume of publication is 72

Blue left arrow Blue left arrow First | Blue left arrow Previous 500 | of 2 | Next 500 Right arrow | Last Right arrow 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
2241929 CIF
HKL
Paper
C20 H30 Cd2 N4 O9C 1 2/c 120.777; 8.2374; 15.002
90; 102.583; 90
2505.9Geiger, David K.; Parsons, Dylan E.; Pagano, Bracco A.
Two cadmium coordination polymers with bridging acetate and phenylenediamine ligands that exhibit two-dimensional layered structures
Acta Crystallographica Section E, 2016, 72, 1718-1723
2241930 CIF
HKL
Paper
C30 H18 N2 O5 SP 1 21/n 112.1347; 12.0708; 17.6391
90; 108.617; 90
2448.5Swaminathan, K.; Narayanan, P.; Sethusankar, K.; Saravanan, Velu; Mohanakrishnan, Arasambattu K.
Crystal structures of two new carbazole derivatives: 12-(4-nitrophenyl)-7-phenylsulfonyl-7<i>H</i>-benzofuro[2,3-<i>b</i>]carbazole and 2-methyl-4-(4-nitrophenyl)-9-phenylsulfonyl-9<i>H</i>-thieno[2,3-<i>b</i>]carbazole
Acta Crystallographica Section E, 2016, 72, 1739-1743
2241931 CIF
HKL
Paper
C27 H18 N2 O4 S2P 1 21/n 112.5052; 11.2594; 17.0731
90; 102.914; 90
2343.1Swaminathan, K.; Narayanan, P.; Sethusankar, K.; Saravanan, Velu; Mohanakrishnan, Arasambattu K.
Crystal structures of two new carbazole derivatives: 12-(4-nitrophenyl)-7-phenylsulfonyl-7<i>H</i>-benzofuro[2,3-<i>b</i>]carbazole and 2-methyl-4-(4-nitrophenyl)-9-phenylsulfonyl-9<i>H</i>-thieno[2,3-<i>b</i>]carbazole
Acta Crystallographica Section E, 2016, 72, 1739-1743
2241932 CIF
HKL
Paper
C37 H32 N6 O12 S2P -18.8764; 13.406; 15.2678
80.466; 85.4332; 78.4602
1753.48Horstman, Elizabeth M.; Bertke, Jeffery A.; Woods, Toby J.; Kenis, Paul J. A.
Crystal structure of a 2:1 piroxicam‒gentisic acid co-crystal featuring neutral and zwitterionic piroxicam molecules
Acta Crystallographica Section E, 2016, 72, 1714-1717
2241933 CIF
HKL
Paper
C14 H31 K O10P 1 21/c 111.683; 8.594; 20.083
90; 100.59; 90
1982.1Liebing, Phil; Zaeni, Ahmad; Olbrich, Falk; Edelmann, Frank T.
Crystal structures of two solvates of (18-crown-6)potassium acetate
Acta Crystallographica Section E, 2016, 72, 1757-1761
2241934 CIF
HKL
C16 H33 K O11P 1 21/c 111.3233; 8.545; 23.3869
90; 99.053; 90
2234.67Liebing, Phil; Zaeni, Ahmad; Olbrich, Falk; Edelmann, Frank T.
Crystal structures of two solvates of (18-crown-6)potassium acetate
Acta Crystallographica Section E, 2016, 72, 1757-1761
2241935 CIF
HKL
Paper
C9 H8 Br NP 1 21/m 14.0382; 8.9362; 12.1015
90; 93.763; 90
435.76Navarrete Guitérrez, Angélica; Aguirre Hernández, Gerardo; Bernès, Sylvain
Crystal structures of <i>p</i>-substituted derivatives of 2,6-dimethylbromobenzene with {σcriptstyle{1øver2}} {łeq} <i>Z</i>' {łeq} 4
Acta Crystallographica Section E, 2016, 72, 1762-1767
2241936 CIF
HKL
Paper
C8 H8 Br N O2P -14.0502; 9.3817; 12.1823
93.498; 99.284; 101.722
445.2Navarrete Guitérrez, Angélica; Aguirre Hernández, Gerardo; Bernès, Sylvain
Crystal structures of <i>p</i>-substituted derivatives of 2,6-dimethylbromobenzene with {σcriptstyle{1øver2}} {łeq} <i>Z</i>' {łeq} 4
Acta Crystallographica Section E, 2016, 72, 1762-1767
2241937 CIF
HKL
Paper
C8 H10 Br NP 1 21/n 110.48314; 6.10173; 26.6195
90; 100.073; 90
1676.48Navarrete Guitérrez, Angélica; Aguirre Hernández, Gerardo; Bernès, Sylvain
Crystal structures of <i>p</i>-substituted derivatives of 2,6-dimethylbromobenzene with {σcriptstyle{1øver2}} {łeq} <i>Z</i>' {łeq} 4
Acta Crystallographica Section E, 2016, 72, 1762-1767
2241938 CIF
HKL
Paper
C8 H9 Br OP b c a14.65213; 17.952; 24.0079
90; 90; 90
6314.92Navarrete Guitérrez, Angélica; Aguirre Hernández, Gerardo; Bernès, Sylvain
Crystal structures of <i>p</i>-substituted derivatives of 2,6-dimethylbromobenzene with {σcriptstyle{1øver2}} {łeq} <i>Z</i>' {łeq} 4
Acta Crystallographica Section E, 2016, 72, 1762-1767
2241939 CIF
HKL
C36 H42 N2 O6P -17.406; 9.042; 11.719
80.42; 81.03; 87.66
764.3Tabuchi, Yohei; Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of hydrogen-bonded co-crystals as liquid crystal precursors: 4-(<i>n</i>-pentyloxy)benzoic acid‒(<i>E</i>)-1,2-bis(pyridin-4-yl)ethene (2/1) and 4-(<i>n</i>-hexyloxy)benzoic acid‒(<i>E</i>)-1,2-bis(pyridin-4-yl)ethene (2/1)
Acta Crystallographica Section E, 2016, 72, 1771-1775
2241940 CIF
HKL
C38 H46 N2 O6P -19.107; 12.02; 16.672
81.584; 88.416; 67.905
1672Tabuchi, Yohei; Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of hydrogen-bonded co-crystals as liquid crystal precursors: 4-(<i>n</i>-pentyloxy)benzoic acid‒(<i>E</i>)-1,2-bis(pyridin-4-yl)ethene (2/1) and 4-(<i>n</i>-hexyloxy)benzoic acid‒(<i>E</i>)-1,2-bis(pyridin-4-yl)ethene (2/1)
Acta Crystallographica Section E, 2016, 72, 1771-1775
2241941 CIF
HKL
C40 H30 Ir N3P 1 21/c 119.8293; 8.6464; 18.1551
90; 106.715; 90
2981.21Lee, Chi-Heon; Moon, Suk-Hee; Park, Ki-Min; Kang, Youngjin
Crystal structure of <i>fac</i>-[2-(4-methyl-5-phenylpyridin-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]bis[2-(pyridin-2-yl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)
Acta Crystallographica Section E, 2016, 72, 1768-1770
2241942 CIF
HKL
Paper
C27 H32 Cl N5 O3P -110.5572; 11.0764; 11.4408
104.622; 97.327; 90.695
1282.57Hu, Xiu-Rong; Ye, Jia-Li; Gu, Jian-Ming
Crystal structure of vilazodone hydrochloride methanol monosolvate
Acta Crystallographica Section E, 2016, 72, 1783-1785
2241943 CIF
HKL
Paper
C60.8 H63.2 N4 Ni4 O12.8P 1 21/c 122.581; 13.7701; 18.5242
90; 92.125; 90
5756Pavlović, Gordana; Majer, Mihael; Cindrić, Marina
A tetranuclear cubane-like nickel(II) complex with a tridentate salicylideneimine Schiff base ligand: tetrakis[μ~3~-4-methyl-<i>N</i>-(2-oxidophenyl)salicylideneiminato]tetrakis[methanolnickel(II)] methanol 0.8-solvate
Acta Crystallographica Section E, 2016, 72, 1776-1779
2241944 CIF
HKL
Paper
C4 H8 Cu N2 O8P 1 21/c 14.8564; 13.5188; 6.7205
90; 96.992; 90
437.94Dickie, Diane A.; Kemp, Richard A.
Crystal structure of <i>catena</i>-poly[diammonium [di-μ-oxalato-cuprate(II)]]
Acta Crystallographica Section E, 2016, 72, 1780-1782
2241945 CIF
HKL
C24 H16 N2 O4P 1 21/n 16.15; 4.7475; 31.002
90; 90.461; 90
905.14Im, Hansu; Moon, Suk-Hee; Kim, Tae Ho; Park, Ki-Min
Crystal structure of <i>N</i>,<i>N</i>'-dibenzylpyromellitic diimide
Acta Crystallographica Section E, 2016, 72, 1809-1811
2241946 CIF
HKL
Paper
C12 H36 I4 Mn O6 S6R -3 :H11.8702; 11.8702; 19.386
90; 90; 120
2365.6Haque, Md Azimul; Davaasuren, Bambar; Rothenberger, Alexander; Wu, Tom
Crystal structure of hexakis(dimethyl sulfoxide-κ<i>O</i>)manganese(II) tetraiodide
Acta Crystallographica Section E, 2016, 72, 1791-1793
2241947 CIF
HKL
Paper
C7 H11 F N O4 PP b c n7.163; 9.1309; 29.694
90; 90; 90
1942.1Rayes, Ali; Dadi, Ahlem; Mahbouli Rhouma, Najla; Mezzadri, Francesco; Calestani, Gianluca
Synthesis and crystal structure of 4-fluorobenzylammonium dihydrogen phosphate, [FC~6~H~4~CH~2~NH~3~]H~2~PO~4~
Acta Crystallographica Section E, 2016, 72, 1812-1815
2241948 CIF
HKL
Paper
C42 H41 Cl3 Cu N O2 P2 S2P -110.7271; 13.5412; 15.9361
67.747; 87.126; 72.826
2041.92Tan, Sang Loon; Yeo, Chien Ing; Heard, Peter J.; Akien, Geoffrey R.; Halcovitch, Nathan R.; Tiekink, Edward R. T.
[<i>N</i>,<i>N</i>-Bis(2-hydroxyethyl)dithiocarbamato-κ^2^<i>S</i>,<i>S</i>']bis(triphenylphosphane-κ<i>P</i>)copper(I) chloroform monosolvate: crystal structure, Hirshfeld surface analysis and solution NMR measurements
Acta Crystallographica Section E, 2016, 72, 1799-1805
2241949 CIF
HKL
Paper
Ca Fe Mn Na2 O12 P3C 1 2/c 112.283; 12.736; 6.494
90; 114.76; 90
922.5Jebli, Semeh; Badri, Abdessalem; Ben Amara, Mongi
Synthesis and crystal structure of a new alluaudite-like iron phosphate Na~2~CaMnFe(PO~4~)~3~
Acta Crystallographica Section E, 2016, 72, 1806-1808
2241950 CIF
HKL
C8 H7 Cs N2 O7 P2P 1 21/c 17.8819; 24.5497; 7.3137
90; 98.739; 90
1398.76Mendes, Ricardo F.; Venkatramaiah, Nutalapati; Tomé, João P. C.; Almeida Paz, Filipe A.
Crystal structure of a compact three-dimensional metal‒organic framework based on Cs^+^ and (4,5-dicyano-1,2-phenylene)bis(phosphonic acid)
Acta Crystallographica Section E, 2016, 72, 1794-1798
2241951 CIF
HKL
Paper
C26 H38 Ag2 N4P b c a11.7112; 15.9238; 14.8703
90; 90; 90
2773.1Wang, Sida; Harmgarth, Nicole; Liebing, Phil; Edelmann, Frank T.
Crystal and molecular structures of two silver(I) amidinates, including an unexpected co-crystal with a lithium amidinate
Acta Crystallographica Section E, 2016, 72, 1786-1790
2241952 CIF
HKL
C87 H132 Ag2 Li2 N8 O2P -110.588; 14.562; 14.983
99.871; 102.825; 106.538
2090.17Wang, Sida; Harmgarth, Nicole; Liebing, Phil; Edelmann, Frank T.
Crystal and molecular structures of two silver(I) amidinates, including an unexpected co-crystal with a lithium amidinate
Acta Crystallographica Section E, 2016, 72, 1786-1790
2241953 CIF
HKL
Paper
C18 H26 Co N4 O2 S2P -17.7027; 7.8688; 9.197
87.403; 81.419; 76.295
535.48Suckert, Stefan; Jess, Inke; Näther, Christian
Crystal structure of bis(3,5-dimethylpyridine-κ<i>N</i>)bis(methanol-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II)
Acta Crystallographica Section E, 2016, 72, 1824-1826
2241954 CIF
HKL
Paper
C16 H25 N3 O6 S2P 1 21 111.419; 5.6731; 15.226
90; 95.53; 90
981.8Toure, Assane; Diop, Libasse; Diop, Cheikh Abdoul Khadir; Oliver, Allen G.
Crystal structure of diethylammonium aniline-4-sulfonate anilinium-4-sulfonate
Acta Crystallographica Section E, 2016, 72, 1830-1832
2241955 CIF
HKL
Paper
C27 H20 O3P 1 21/c 118.5975; 12.9604; 16.89
90; 96.365; 90
4045.92Siqingaowa; Tsumuki, Takehiro; Ogata, Kazuki; Yonezawa, Noriyuki; Okamoto, Akiko
1-[(Anthracen-9-yl)carbonyl]-2,7-dimethoxynaphthalene: a chain-like structure composed of face-to-face type dimeric molecular aggregates
Acta Crystallographica Section E, 2016, 72, 1819-1823
2241956 CIF
HKL
C7 H13 N3 O3 SP c a 218.3367; 10.7752; 24.1016
90; 90; 90
2165.04Kwon, Eunjin; Park, Ki-Min; Park, Hyunjin; Kim, Tae Ho
Crystal structure of oxamyl
Acta Crystallographica Section E, 2016, 72, 1816-1818
2241957 CIF
HKL
Paper
C36 H40 Cd N6 O8P -17.5125; 8.6671; 15.3079
86.198; 76.249; 74.73
933.97Akduran, Nurcan; Sertçelik, Mustafa; Aydoğdu, Ömer; Necefoğlu, Hacali; Hökelek, Tuncer
Crystal structure of <i>trans</i>-diaquabis(4-cyanobenzoato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>)cadmium
Acta Crystallographica Section E, 2016, 72, 1827-1829
2241958 CIF
HKL
C28 H38 F3 O3 S Si TiP -18.9431; 12.3682; 13.886
66.795; 85.501; 86.367
1406.44Kessler, Monty; Godemann, Christian; Spannenberg, Anke; Beweries, Torsten
Crystal structures of two <i>ansa</i>-titanocene trifluoromethanesulfonate complexes bearing the Me~2~Si(C~5~Me~4~)~2~ ligand
Acta Crystallographica Section E, 2016, 72, 1833-1835
2241959 CIF
HKL
C21 H30 Cl F3 O3 S Si TiP 1 21/n 110.0958; 15.8656; 14.5544
90; 91.9841; 90
2329.87Kessler, Monty; Godemann, Christian; Spannenberg, Anke; Beweries, Torsten
Crystal structures of two <i>ansa</i>-titanocene trifluoromethanesulfonate complexes bearing the Me~2~Si(C~5~Me~4~)~2~ ligand
Acta Crystallographica Section E, 2016, 72, 1833-1835
2241960 CIF
HKL
C7 H5 Cl2 F N2 O3P -17.1116; 7.6131; 8.9414
86.927; 80.354; 72.587
455.38Park, Hyunjin; Choi, Myong Yong; Kwon, Eunjin; Kim, Tae Ho
Crystal structure of fluroxypyr
Acta Crystallographica Section E, 2016, 72, 1836-1838
2241961 CIF
HKL
Paper
C32 H28 N6 O12 S4P -17.3861; 8.5629; 15.1619
75.839; 79.196; 70.1
868.55Tantardini, Christian; Arkhipov, Sergey G.; Cherkashina, Ksenya A.; Kil'met'ev, Alexander S.; Boldyreva, Elena V.
Crystal structure of a 2:1 co-crystal of meloxicam with acetylendicarboxylic acid
Acta Crystallographica Section E, 2016, 72, 1856-1859
2241962 CIF
HKL
Paper
C28 H27 Cu I N3P 1 21/c 114.689; 8.0775; 21.861
90; 103.942; 90
2517.4Al-Najjar, Nada; Solan, Gregory A.; Singh, Kuldip
Crystal structure of (acetonitrile-κ<i>N</i>)iodido(2-(naphthalen-1-yl)-6-{1-[(2,4,6-trimethylphenyl)imino]ethyl}pyridine-κ^2^<i>N</i>,<i>N</i>')copper(I)
Acta Crystallographica Section E, 2016, 72, 1845-1847
2241963 CIF
HKL
Paper
C23 H14 N4 O7P 1 21/c 120.7156; 6.366; 16.0288
90; 105.183; 90
2040.02Köysal, Yavuz; Bülbül, Hakan; İlhan, İlhan Özer; Akın, Nazenin; Dege, Necmi
Crystal structure and computational studies of (3<i>Z</i>)-4-benzoyl-3-[(2,4-dinitrophenyl)hydrazinylidene]-5-phenylfuran-2(3<i>H</i>)-one
Acta Crystallographica Section E, 2016, 72, 1852-1855
2241964 CIF
HKL
Paper
C70 H126 Cl6 Fe6 N8 O35 S13P -111.4286; 12.7227; 20.1915
94.005; 105.839; 103.952
2712Chygorin, Eduard; Smal, Yuri; Omelchenko, Irina V.
Crystal structure of bis(bis{μ~3~-3-methyl-3-[(4-nitro-2-oxidobenzylidene)amino]propane-1,3-diolato}tris[chlorido(dimethyl sulfoxide)iron(III)]) dimethyl sulfoxide heptasolvate dihydrate
Acta Crystallographica Section E, 2016, 72, 1848-1851
2241965 CIF
HKL
Paper
Ag4 F8 H30 N10 SnP 1 21/c 17.3274; 19.4495; 7.8579
90; 113.205; 90
1029.27Kraus, Florian; Fichtl, Matthias; Baer, Sebastian
Crystal structure of [Ag(NH~3~)~3~]~2~[Ag(NH~3~)~2~]~2~[SnF~6~]F~2~, a compound showing argentophilic interactions
Acta Crystallographica Section E, 2016, 72, 1860-1863
2241966 CIF
HKL
Paper
C14 H18 O8P 1 21 19.5538; 8.3655; 19.1395
90; 96.837; 90
1518.8Schilde, Uwe; Kelling, Alexandra; Umbreen, Sumaira; Linker, Torsten
Crystal structures of three bicyclic carbohydrate derivatives
Acta Crystallographica Section E, 2016, 72, 1839-1844
2241967 CIF
HKL
Paper
C11 H15 N O6P 1 21 18.991; 9.6231; 14.4915
90; 101.742; 90
1227.59Schilde, Uwe; Kelling, Alexandra; Umbreen, Sumaira; Linker, Torsten
Crystal structures of three bicyclic carbohydrate derivatives
Acta Crystallographica Section E, 2016, 72, 1839-1844
2241968 CIF
HKL
Paper
C14 H19 N O8P 1 21 17.0784; 6.1454; 18.5176
90; 100.476; 90
792.08Schilde, Uwe; Kelling, Alexandra; Umbreen, Sumaira; Linker, Torsten
Crystal structures of three bicyclic carbohydrate derivatives
Acta Crystallographica Section E, 2016, 72, 1839-1844
2241970 CIF
HKL
Paper
C6 H16 Cr N2 O4P b c a9.91; 8.373; 22.999
90; 90; 90
1908.4Moon, Dohyun; Choi, Jong-Ha
Crystal structure of <i>trans</i>-cyclohexane-1,2-diammonium chromate(VI) from synchrotron X-ray diffraction data
Acta Crystallographica Section E, 2016, 72, 1872-1874
2241971 CIF
HKL
Paper
C5 H4 Cl N O SeP 1 21/c 13.9601; 7.5102; 22.35
90; 94.32; 90
662.8Askerov, Rizvan K.; Matsulevich, Zhanna V.; Borisova, Galina N.; Zalepkina, Svetlana A.; Smirnov, Vasiliy F.; Grishina, Maria M.; Dorovatovskii, Pavel V.; Borisov, Alexander V.; Khrustalev, Victor N.
The synthesis and crystal structure of 2-(chloroselanyl)pyridine 1-oxide: the first monomeric organoselenenyl chloride stabilized by an intramolecular secondary Se···O interaction
Acta Crystallographica Section E, 2016, 72, 1864-1866
2241972 CIF
HKL
Paper
C16 H10 Br Cl2 N OP 1 21/n 110.2155; 11.3645; 13.5252
90; 101.141; 90
1540.6Zhang, Ting-ting; Wang, Bing; Lu, Qing; Zhao, Jun-fang; Lei, Hong; Fang, Qi
Synthesis and structure of 1-(2-bromophenyl)-2-chloro-3-(2-chloracetyl)-1<i>H</i>-indole
Acta Crystallographica Section E, 2016, 72, 1867-1871
2311093 CIFHf Na2 O7 Si2P -16.6123; 8.7948; 5.41074
92.603; 94.0843; 71.3262
297.249Massoni, Nicolas; Pierrick, Chevreux
Crystal structure of Na~2~HfSi~2~O~7~ by Rietveld refinement
Acta Crystallographica, Section e, 2016, 72, 1434
9017352 CIFAs0.02 Fe0.09 H Mn0.82 O9 Pb2 V1.98 Zn0.09P 1 21/m 17.6492; 6.1262; 8.9241
90; 112.195; 90
387.202Lafuente, B.; Downs, R. T.
Redetermination of brackebuschite, Pb2Mn3+(VO4)2(OH)
Acta Crystallographica, Section E, 2016, 72, 293-296
9017353 CIFAl0.05 Ca1.9 Fe0.07 H8 Mg0.04 Mn1.88 O17 Si4 Sr0.06C 1 2 19.036; 6.1683; 11.9601
90; 91.433; 90
666.409Fendrich, K. V.; Downs, R. T.; Origlieri, M. J.
Redetermination of ruizite, Ca2Mn3+2[Si4O11(OH)](OH)2*2H2O
Acta Crystallographica, Section E, 2016, 72, 959-963
9017354 CIFCa0.968 H4 O8 V1.885P -16.2059; 7.0635; 7.7516
93.166; 96.548; 105.883
323.359Kobsch, A.; Downs, R. T.; Domanik, K. J.
Redetermination of metarossite, CaV5+2O6*2H2O
Acta Crystallographica, Section E, 2016, 72, 1280-1284

Blue left arrow Blue left arrow First | Blue left arrow Previous 500 | of 2 | Next 500 Right arrow | Last Right arrow 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!