Crystallography Open Database

Result: there are 958 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 space group like 'P 41 21 2'

Blue left arrow Blue left arrow First | Blue left arrow Previous 100 | of 10 | Next 100 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
2105868 CIFC5 H5 N OP 41 21 25.5678; 5.5678; 13.514
90; 90; 90		418.94Patyk, Ewa; Marciniak, Jedrzej; Tomkowiak, Hanna; Katrusiak, Andrzej; Merz, Klaus
Isothermal and isochoric crystallization of highly hygroscopic pyridine <i>N</i>-oxide of aqueous solution
Acta Crystallographica Section B, 2014, 70, 487-491
2105869 CIF
HKL		C5 H5 N OP 41 21 25.498; 5.498; 13.334
90; 90; 90		403.06Patyk, Ewa; Marciniak, Jedrzej; Tomkowiak, Hanna; Katrusiak, Andrzej; Merz, Klaus
Isothermal and isochoric crystallization of highly hygroscopic pyridine <i>N</i>-oxide of aqueous solution
Acta Crystallographica Section B, 2014, 70, 487-491
2105956 CIFH14 Na2 O11 SP 41 21 214.3249; 14.3249; 22.202
90; 90; 90		4555.9Kamburov, Stoyan; Schmidt, Horst; Voigt, Wolfgang; Balarew, Christo
Similarities and peculiarities between the crystal structures of the hydrates of sodium sulfate and selenate
Acta Crystallographica Section B, 2014, 70, 714-722
2106317 CIFAs4 MgP 41 21 25.385; 5.385; 15.798
90; 90; 90		458.114Gerardin, R.; Aubry, J.
Structure cristalline de la phase Mg As4
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2091-2094
2106470 CIFNi2 Y3P 41 21 27.104; 7.104; 36.597
90; 90; 90		1846.93le Roy, J.; Moreau, J.M.; Paccard, D.; Parthe, E.
Y3 Ni2: A new tetragonal phase with Ni-centred trigonal prism
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3406-3409
2106589 CIFMn5 Si2P 41 21 28.9097; 8.9097; 8.7153
90; 90; 90		691.845Shoemaker, C.B.; Shoemaker, D.P.
Crystal structure of Mn5 Si2 and the d phase (V-Fe-Si)*
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 2306-2313
2107164 CIFH2 OP 41 21 26.73; 6.73; 6.83
90; 90; 90		309.351Kamb, B.; Prakash, A.
Structure of ice III
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1317-1327
2108472 CIF
HKL		C25 H28 N2 O8.5 SP 41 21 212.89179; 12.89179; 29.5087
90; 90; 90		4904.29Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J.
Understanding the formation of apremilast cocrystals
Acta Crystallographica Section B, 2019, 75
2108473 CIF
HKL		C25 H27 N3 O7.5 SP 41 21 212.81222; 12.81222; 29.7274
90; 90; 90		4879.84Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J.
Understanding the formation of apremilast cocrystals
Acta Crystallographica Section B, 2019, 75
2108474 CIF
HKL		C23.5 H25 N3 O7.5 SP 41 21 212.85808; 12.85808; 29.5715
90; 90; 90		4889.06Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J.
Understanding the formation of apremilast cocrystals
Acta Crystallographica Section B, 2019, 75
2108475 CIF
HKL		C25 H28 N2 O8.5 SP 41 21 212.88747; 12.88747; 29.5246
90; 90; 90		4903.65Dudek, Marta K.; Wielgus, Ewelina; Paluch, Piotr; Śniechowska, Justyna; Kostrzewa, Maciej; Day, Graeme M.; Bujacz, Grzegorz D.; Potrzebowski, Marek J.
Understanding the formation of apremilast cocrystals
Acta Crystallographica Section B, 2019, 75
2200065 CIF
HKL
Paper		C6 H18 S3 Sn3P 41 21 29.7249; 9.7249; 17.3867
90; 90; 90		1644.32Farina, Yang; Baba, Ibrahim; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng
Tetragonal modification of 1,1,3,3,5,5-hexamethylcyclo-1,3,5-tristannathiane
Acta Crystallographica Section E, 2001, 57, m37-m38
2200823 CIF
HKL
Paper		C41 H49 N7 O6 SP 41 21 212.805; 12.805; 54.013
90; 90; 90		8856Mitsunobu Doi; Aiko Yumiba; Akiko Asano
The <i>cis,cis</i>-proline isomer of ceratospongamide
Acta Crystallographica Section E, 2002, 58, o62-o64
2201186 CIF
HKL
Paper		C8 H15 O15 SmP 41 21 26.103; 6.103; 36.826
90; 90; 90		1371.64Wu, Chuan-De; Zhan, Xiao-Ping; Lu, Can-Zhong; Zhuang, Hong-Hui; Huang, Jin-Shun
Poly[triaqua(μ-hydrogen tartrato)(μ-tartrato)samarium(III)]
Acta Crystallographica Section E, 2002, 58, m228-m230
2201613 CIF
HKL
Paper		C10 H9 N O3P 41 21 211.438; 11.438; 14.284
90; 90; 90		1868.7Kolb, Vera M.; Donahue, Matthew G.; Putnam, Eric A.; Meyers, Cal Y.; Robinson, Paul D.
Cyclopropyl <i>m</i>-nitrophenyl ketone
Acta Crystallographica Section E, 2002, 58, o1161-o1163
2201918 CIF
HKL
Paper		C32 H46 O19P 41 21 214.9188; 14.9188; 17.8355
90; 90; 90		3969.7Thomas C. Baddeley; Simon M. Clow; Philip J. Cox; Iain G. Davidson; Clare Ryder; James L. Wardell
Disordered 4,4'-di-<i>O</i>-isobutyroyl-2,2',3,3',6,6'-hex-<i>O</i>-acetyl-α,α'-trehalose
Acta Crystallographica Section E, 2003, 59, o848-o850
2202733 CIF
HKL
Paper		C20 H40 I K O8P 41 21 212.2645; 12.2645; 34.372
90; 90; 90		5170.2Liddle, Stephen T.; Clegg, William
(18-Crown-6)-bis(tetrahydrofuran)potassium iodide
Acta Crystallographica Section E, 2003, 59, m1184-m1186
2202769 CIF
HKL
Paper		C54 H60 Cl2 N4 Ni2 O14P 41 21 211.536; 11.536; 43.015
90; 90; 90		5724Wu, Jin-Cai; Li, Yi-Zhi; Tang, Ling; Tan, Min-Yu
[μ-10,21-Di-<i>tert</i>-butyl-4(<i>S</i>),5(<i>S</i>),15(<i>S</i>),16(<i>S</i>)-tetraphenyl-3,6,14,17-tetraazatricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17,19,21-decaene-23,24-diolato](μ-ethylene glycol)dinickel(II) diperchlorate dihydrate
Acta Crystallographica Section E, 2003, 59, m494-m496
2203693 CIF
HKL
Paper		C24 H34 N2 O4 S5P 41 21 212.377; 12.377; 18.296
90; 90; 90		2802.8Blake, Alexander J.; Lippolis, Vito; Schröder, Martin
10,13-Bis(<i>p</i>-tolylsulfonyl)-1,4,7-trithia-10,13-diazacyclopentadecane
Acta Crystallographica Section E, 2004, 60, o901-o903
2204132 CIF
HKL
Paper		C8 H17 N O6P 41 21 27.623; 7.623; 33.8174
90; 90; 90		1965.13Christopher Newton; Jeroen van Ameijde; George W. J. Fleet; Robert J. Nash; Watkin, David J.
3-<i>epi</i>-Casuarine monohydrate
Acta Crystallographica Section E, 2004, 60, o1463-o1464
2204563 CIF
HKL
Paper		C15 H26 Cu N4 O4P 41 21 28.2446; 8.2446; 25.088
90; 90; 90		1705.3Shim, Yoon-Bo; Choi, Sung-Nak; Lee, Seung Jae; Kang, Sung Kwon; Lee, Yong-Min
[(6<i>R</i>,7<i>S</i>,8<i>S</i>,14<i>R</i>)-(‒)-α-Isosparteine-κ^2^<i>N</i>,<i>N</i>']bis(nitrito-κ^2^<i>O</i>,<i>O</i>')copper(II)
Acta Crystallographica Section E, 2004, 60, m1573-m1575
2206708 CIF
HKL
Paper		C14 H8 O4P 41 21 25.744; 5.744; 31.393
90; 90; 90		1035.77Zain, Sharifuddin M.; Ng, Seik Weng
1,8-Dihydroxyanthraquinone
Acta Crystallographica Section E, 2005, 61, o2921-o2923
2207018 CIF
HKL
Paper		C26 H18 Co N4 O2P 41 21 29.9452; 9.9452; 22.581
90; 90; 90		2233.4Bu, Huai-Yu; Liu, Yong-Jun; Liu, Qing-Fang; Jia, Jing-Fen
Bis[2-(benzimidazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]cobalt(II)
Acta Crystallographica Section E, 2005, 61, m1986-m1987
2208903 CIF
HKL
Paper		C34 H43 O10.5 P2P 41 21 213.115; 13.115; 39.441
90; 90; 90		6784Gainsford, Graeme J.; Lensink, Cornelis; Falshaw, Andrew
1<small>D</small>-1,2,5,6-Tetra-<i>O</i>-methyl-3,4-di-<i>O</i>-phosphinoyl-<i>chiro</i>-inositol 2.5-hydrate
Acta Crystallographica Section E, 2006, 62, o2099-o2101
2209097 CIF
HKL
Paper		C12 H16 N2 O4 SP 41 21 29.6392; 9.6392; 31.162
90; 90; 90		2895.4Yu-Ye Yu
<i>N</i>-Cyclohexyl-2-nitrobenzenesulfonamide
Acta Crystallographica Section E, 2006, 62, o2263-o2264
2209851 CIF
HKL
Paper		C12 H10 N2 O4 ZnP 41 21 27.9687; 7.9687; 17.7213
90; 90; 90		1125.31Miao, Xiao-He; Xiao, Hong-Ping; Zhu, Long-Guan
Poly[zinc(II)-μ~2~-4,4'-bipyridine-di-μ~2~-formato]: a chiral three-dimensional coordination polymer
Acta Crystallographica Section E, 2006, 62, m1756-m1757
2210089 CIF
Paper		C12 H8 Co N2 O4P 41 21 27.861; 7.861; 20.92
90; 90; 90		1293Wen-Jun Feng; Guang-Peng Zhou; Xue-Fang Zheng; Yu-Guo Liu; Yan Xu
Poly[di-μ-nicotinato-cobalt(II)]
Acta Crystallographica Section E, 2006, 62, m2033-m2035
2210319 CIF
HKL
Paper		C44 H32 N6 O6 S2 ZnP 41 21 212.4631; 12.4631; 24.538
90; 90; 90		3811.5Pei-Xia Dai; Jian-Hua Guo; En-Cui Yang
Bis(2-aminonaphthalene-1-sulfonato-κ<i>O</i>)bis(1,10-phenanthroline)zinc(II)
Acta Crystallographica Section E, 2006, 62, m2096-m2098
2211264 CIF
HKL
Paper		C30 H26 N4 O6 ZnP 41 21 210.3578; 10.3578; 25.651
90; 90; 90		2751.9Yu, Zong-Xue; Qi, Jun-Sheng; Liang, Ke-Zhong; Sun, Yu-Xi
Bis[2-hydroxy-<i>N</i>'-(2-methoxybenzylidene)benzohydrazidato]zinc(II)
Acta Crystallographica Section E, 2006, 62, m3284-m3286
2211351 CIF
HKL
Paper		C18 H34 Cl2 Cu N12 O11P 41 21 29.2157; 9.2157; 37.458
90; 90; 90		3181.3Xiang, Qun; Cheng, Yu; Ling, Yun; Zhang, Lei; Shi, Li-Yi
Triaquabis[bis(3,5-dimethyl-1,2,4-triazol-1-yl)methane-κ<i>N</i>^4^]copper(II) bis(perchlorate)
Acta Crystallographica Section E, 2006, 62, m3462-m3464
2211507 CIF
HKL
Paper		C44 H32 Co N6 O6 S2P 41 21 212.468; 12.468; 24.51
90; 90; 90		3810.1Jian-Hua Sun; Xin Feng
Bis(2-aminonaphthalene-1-sulfonato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)
Acta Crystallographica Section E, 2006, 62, m3370-m3372
2211925 CIF
HKL
Paper		C9 H4 Cl8P 41 21 28.518; 8.518; 38.236
90; 90; 90		2774.3Wilson, Zakiya S.; Davila, Alfonso; McLaughlin, Mark L.; Watkins, Steven F.; Fronczek, Frank R.
(1<i>S</i>,4<i>R</i>)-1,2,3,4,7,7-Hexachloro-5,6-bis(chloromethyl)bicyclo[2.2.1]hepta-2,5-diene
Acta Crystallographica Section E, 2007, 63, o303-o305
2213357 CIF
HKL
Paper		C16 H24 Br2 Ir2P 41 21 28.3839; 8.3839; 24.1471
90; 90; 90		1697.3Tsuneaki Yamagata; Mitsuhiro Nagata; Kazushi Mashima; Kazuhide Tani
Di-μ-bromido-bis[(η^4^-cycloocta-1,5-diene)iridium(I)]
Acta Crystallographica Section E, 2007, 63, m1498-m1498
2214211 CIF
HKL
Paper		C36 H28 N2 O4P 41 21 211.3285; 11.3285; 23.837
90; 90; 90		3059.1Chai, Wen-Li; Bi, Wei-Yu; Lü, Xing-Qiang; Song, Ji-Rong; Ng, Seik Weng
(<i>S</i>)-(+)-2,2'-Bis(2-hydroxy-3-methoxybenzylideneamino)-1,1'-binaphthyl
Acta Crystallographica Section E, 2007, 63, o3060-o3060
2214380 CIF
HKL
Paper		C32 H36 B2 F8 P4 PtP 41 21 210.8327; 10.8327; 29.1244
90; 90; 90		3417.67Morey, Tara S.; Miller, Susie M.; Helm, Monte L.
Bis(<i>cis</i>-1,4-diphenyl-1,4-diphosphacyclohexane-κ^2^<i>P</i>,<i>P</i>')platinum(II) bis(tetrafluoridoborate)
Acta Crystallographica Section E, 2007, 63, m1983-m1983
2214993 CIF
HKL
Paper		C8 H9 Br O3P 41 21 27.9963; 7.9963; 25.793
90; 90; 90		1649.2Koşar, Başak; Karaarslan, Muhsin; Demircan, Aydın; Büyükgüngör, Orhan
3a-Bromoperhydro-2,6a-epoxyoxireno[<i>e</i>][2]benzofuran
Acta Crystallographica Section E, 2007, 63, o3691-o3691
2216591 CIF
HKL
Paper		C25 H20 N2 O2P 41 21 211.607; 11.607; 14.101
90; 90; 90		1899.7Ono, Katsuhiko; Tomura, Masaaki; Saito, Katsuhiro
9,9-Bis(4-methoxyphenyl)-9<i>H</i>-cyclopenta[2,1-<i>b</i>:3,4-<i>b</i>']dipyridine
Acta Crystallographica Section E, 2007, 63, o4612-o4612
2217758 CIF
HKL
Paper		C25 H26 N2 TeP 41 21 210.6004; 10.6004; 20.4365
90; 90; 90		2296.42Yalçın, Şerife Pınar; Akkurt, Mehmet; Yılmaz, Ülkü; Küçükbay, Hasan; Büyükgüngör, Orhan
1,3-Bis(3-phenylpropyl)-1<i>H-</i>benzimidazole-2(3<i>H</i>)-tellurone
Acta Crystallographica Section E, 2008, 64, o621-o622
2218024 CIF
HKL
Paper		C13 H12 N2 O2 SP 41 21 29.445; 9.445; 27.107
90; 90; 90		2418.2Pérez, Hiram; Mascarenhas, Yvonne; Estévez-Hernández, Osvaldo; Santos Jr, Sauli; Duque, Julio
1-Benzyl-3-(2-furoyl)thiourea
Acta Crystallographica Section E, 2008, 64, o695
2218046 CIF
HKL
Paper		C42 H54 O6P 41 21 213.5981; 13.5981; 18.726
90; 90; 90		3462.6Qin, Song; Shi, Lei; Li, Jia; Guo, Yue-Wei
Bispuupehenone from the South Chinese Sea sponge <i>Dysidea</i> sp.
Acta Crystallographica Section E, 2008, 64, o946-o947
2218747 CIF
HKL
Paper		C23 H26 Cl2 Cu N8 O8P 41 21 214.6374; 14.6374; 27.3945
90; 90; 90		5869.4Liu, Chunyi; Zhou, Anyu; Wang, Songpei; Chen, Zhengping
Bis[4,5-dimethyl-2-(2-pyridyl)-1<i>H</i>-imidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^](1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) bis(perchlorate)
Acta Crystallographica Section E, 2008, 64, m914-m915
2218778 CIF
HKL
Paper		C24 H28 Cl4 Co N6P 41 21 29.5706; 9.5706; 29.911
90; 90; 90		2739.7Zhang, Zhong; Zhao, Yao; Geng, Zhi-Rong; Wang, Zhi-Lin
Dichloridobis[2-(2-chloroethyl)-1,2,3,4-tetrahydropyrazino[1,2-<i>a</i>]benzimidazole-κ<i>N</i>]cobalt(II)
Acta Crystallographica Section E, 2008, 64, m942-m943
2219327 CIF
HKL
Paper		C14 H14 O2P 41 21 27.39307; 7.39307; 20.1623
90; 90; 90		1102.02Nakaema, Kosuke; Okamoto, Akiko; Maruyama, Satoshi; Noguchi, Keiichi; Yonezawa, Noriyuki
2,2'-Dimethoxybiphenyl
Acta Crystallographica Section E, 2008, 64, o1731
2219574 CIF
HKL
Paper		C18 H12 Hg I3 N3 O4P 41 21 211.9338; 11.9338; 16.0532
90; 90; 90		2286.23Zhang, Yu; Zhao, Jianying; Tang, Guodong; Jiang, Zhengjing
<i>catena</i>-Poly[[dipyridinemercury(II)]-μ-5-amino-2,4,6-triiodoisophthalato]
Acta Crystallographica Section E, 2008, 64, m1324
2227990 CIF
HKL
Paper		C18 H12 Cd I3 N3 O4P 41 21 211.824; 11.824; 15.841
90; 90; 90		2214.7Zou, Yang
<i>catena</i>-Poly[[dipyridinecadmium(II)]-<i>{μ</i>}-5-amino-2,4,6-triiodoisophthalato]
Acta Crystallographica Section E, 2010, 66, m1371
2228655 CIF
HKL
Paper		C26 H26 Au2 Cl2 N2 P2P 41 21 210.672; 10.672; 23.439
90; 90; 90		2669.5Kriel, Frederik H.; Fernandes, Manuel A.; Coates, Judy
[μ-1,2-Bis(diphenylphosphanyl)-1,2-dimethylhydrazine-κ^2^<i>P</i>:<i>P</i>']bis[chloridogold(I)]
Acta Crystallographica Section E, 2011, 67, m42
2230120 CIF
HKL
Paper		C25 H26 N2 SeP 41 21 210.515; 10.515; 19.8142
90; 90; 90		2190.76Akkurt, Mehmet; Yılmaz, Ülkü; Küçükbay, Hasan; Büyükgüngör, Orhan
1,3-Bis(3-phenylpropyl)-1<i>H</i>-1,3-benzimidazole-2(3<i>H</i>)-selone
Acta Crystallographica Section E, 2011, 67, o1179
2230774 CIF
HKL
Paper		C15 H24 Cl N2 O0.5 SP 41 21 27.793; 7.793; 52.59
90; 90; 90		3194Wang, Liang; Zhang, Chun-Mei; Guo, Jun-Xiang; Wu, Qiu-Ye; Hu, Hong-Gang
(6a<i>S</i>,11a<i>R</i>,11c<i>S</i>)-8-Sulfanylidene-2,3,5,6,6a,7,11,11a,11b,11c-decahydro-3a,7a-diaza-1<i>H</i>,4<i>H</i>-benzo[<i>de</i>]anthracen-3a-ium chloride hemihydrate
Acta Crystallographica Section E, 2011, 67, o1743-o1744
2231328 CIF
HKL
Paper		C31 H28 Cu N2 O2P 41 21 29.7435; 9.7435; 25.717
90; 90; 90		2441.5Kargar, Hadi; Kia, Reza; Moghadam, Majid; Froozandeh, Fatemeh; Tahir, Muhammad Nawaz
{2,2'-[(2,2-Dimethylpropane-1,3-diyldinitrilo)bis(phenylmethylidyne)]diphenolato}copper(II)
Acta Crystallographica Section E, 2011, 67, m1145
2232232 CIF
HKL
Paper		C18 H17 Fe N O3P 41 21 27.5477; 7.5477; 53.351
90; 90; 90		3039.3Auzias, Mathieu; Süss-Fink, Georg; Therrien, Bruno
[6-(Hydroxymethyl)pyridin-2-yl]methyl ferrocene-1-carboxylate
Acta Crystallographica Section E, 2011, 67, m1618
2232847 CIF
HKL
Paper		C13 H16 O4P 41 21 210.5677; 10.5677; 21.4244
90; 90; 90		2392.6Akerman, Matthew P.; Mkhize, Zimbili; van Heerden, Fanie R.
1-(5,7-Dihydroxy-2,2-dimethylchroman-6-yl)ethanone
Acta Crystallographica Section E, 2011, 67, o3412
2233023 CIF
HKL
Paper		C9 H10 O4P 41 21 28.1423; 8.1423; 27.6814
90; 90; 90		1835.2Portalone, Gustavo
A new polymorph of 2,6-dimethoxybenzoic acid
Acta Crystallographica Section E, 2011, 67, o3394-o3395
2233432 CIF
HKL
Paper		C12 H24 N10 O10 ZnP 41 21 212.1252; 12.1252; 14.6108
90; 90; 90		2148.1Liu, Xun-Gao; Shen, Liang; Cai, Qi-Suo; Luo, Ma
Bis[(1<i>S</i>,1'<i>S</i>)-1,1'-(4-amino-4<i>H</i>-1,2,4-triazole-3,5-diyl)diethanol-κ<i>N</i>^1^]bis(nitrato-κ<i>O</i>)zinc
Acta Crystallographica Section E, 2012, 68, m191-m192
2233854 CIF
HKL
Paper		C19 H34 N2 SP 41 21 26.1008; 6.1008; 53.79
90; 90; 90		2002.05Umar, M. Naveed; Tahir, M. Nawaz; Shoaib, Mohammad; Ali, Akbar; Ziauddin
1,3-Bis(1-cyclohexylethyl)imidazolidine-2-thione
Acta Crystallographica Section E, 2012, 68, o743
2235612 CIF
HKL
Paper		C17 H15 N3 O6 SP 41 21 29.6818; 9.6818; 44.017
90; 90; 90		4126Khan, Islam Ullah; Mubashar-ur-Rehman, Hafiz; Aziz, Salman; Harrison, William T. A.
3-(1<i>H</i>-Indol-3-yl)-2-(2-nitrobenzenesulfonamido)propanoic acid including an unknown solvate
Acta Crystallographica Section E, 2012, 68, o2019
2235792 CIF
HKL
Paper		C16 H24 O3P 41 21 27.3359; 7.3359; 54.7419
90; 90; 90		2945.96Tebbaa, Mohamed; Benharref, Ahmed; Daran, Jean-Claude; Barkaoui, Latifa; Berraho, Moha
Methyl 2-(4a,8-Dimethyl-7-oxodecahydronaphthalen-2-yl)acrylate
Acta Crystallographica Section E, 2012, 68, o2391
2236581 CIF
HKL
Paper		C15 H20 O4P 41 21 26.4737; 6.4737; 62.438
90; 90; 90		2616.7Liu, Ting-ting; Wu, Hai-Bo; Wang, Wen-Shu
6,8-Dihydroxy-8a-methyl-3,5-dimethylidenedecahydronaphtho[2,3-<i>b</i>]furan-2(3<i>H</i>)-one
Acta Crystallographica Section E, 2012, 68, o3251
2237105 CIF
HKL
Paper		C21 H26 F3 O3 P SP 41 21 212.1339; 12.1339; 30.057
90; 90; 90		4425.3Muller, Alfred; Holzapfel, Cedric W.
(Biphenyl-2,2'-diyl)di-<i>tert</i>-butylphosphonium trifluoromethanesulfonate
Acta Crystallographica Section E, 2013, 69, o20
2237237 CIF
HKL
Paper		C19 H15 N3 O2P 41 21 25.0314; 5.0314; 58.701
90; 90; 90		1486.01Mahboubi Anarjan, Parisa; Noshiranzadeh, Nader; Bikas, Rahman; Woińska, Magdalena; Wozniak, Krzysztof
<i>N</i>,<i>N</i>'-(Pyridine-2,6-diyl)dibenzamide
Acta Crystallographica Section E, 2013, 69, o102
2237314 CIF
HKL
Paper		C8 H8 N6 OP 41 21 29.548; 9.548; 21.957
90; 90; 90		2001.69Hernández-Gil, Javier; Ferrer, Sacramento; Ballesteros, Rafael; Castiñeiras, Alfonso
<i>N</i>-(5-Amino-1<i>H</i>-1,2,4-triazol-3-yl)pyridine-2-carboxamide
Acta Crystallographica Section E, 2013, 69, o227-o228
2237446 CIF
HKL
Paper		C32 H27 N2 O7.5P 41 21 210.6848; 10.6848; 47.9935
90; 90; 90		5479.2Chin, Jik; Koh, Dongsoo; Lough, Alan J.
2,2'-[(1<i>S</i>,2<i>S</i>)-1,2-Bis(2-hydroxyphenyl)ethane-1,2-diyl]bis(isoindoline-1,3-dione) ethanol monosolvate hemihydrate
Acta Crystallographica Section E, 2013, 69, o406-o407
2238246 CIF
HKL
Paper		C7 H8 N2 O2P 41 21 28.774; 8.774; 10.0282
90; 90; 90		772Haines, Alan H.; Hughes, David L.
(4<i>S</i>,5<i>S</i>)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarbonitrile
Acta Crystallographica Section E, 2013, 69, o1104
2238354 CIF
HKL
Paper		C28 H40 N2 O2 S2P 41 21 213.8159; 13.8159; 13.5221
90; 90; 90		2581.09Walker, Ashley; Forsyth, Craig M.; Perlmutter, Patrick
2-(10',10'-Dimethyl-3'-sulfanylidene-4'-azatricyclo[5.2.1.0^1,5^]decan-2'-yl)-10,10-dimethyl-4-azatricyclo[5.2.1.0^1,5^]decane-3-thione
Acta Crystallographica Section E, 2013, 69, o1282
2239469 CIF
HKL
Paper		C24 H24 B F4 NP 41 21 29.367; 9.367; 49.137
90; 90; 90		4311Ben Ali, Karim; Retailleau, Pascal
(3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-2-[(<i>R</i>)-1-phenylethyl]-3,4-dihydroisoquinolin-2-ium tetrafluoridoborate
Acta Crystallographica Section E, 2014, 70, o255
2239510 CIF
HKL
Paper		C28 H56 Cl4 Cu4 N4 O4P 41 21 213.9016; 13.9016; 38.834
90; 90; 90		7504.8Luo, Mei; Huang, Yong-Hua; Zhang, Jing-Cheng
Tetrakis[μ~3~-2-(piperidin-1-yl)ethanolato]tetrakis[chloridocopper(II)]
Acta Crystallographica Section E, 2014, 70, m194
2239780 CIF
HKL
Paper		C8 H8 Br4 N2P 41 21 29.6858; 9.6858; 26.5116
90; 90; 90		2487.2Assoumatine, Tokouré; Stoeckli-Evans, Helen
Crystal structure of a tetrakis-substituted pyrazine compound: 2,3,5,6-tetrakis(bromomethyl)pyrazine
Acta Crystallographica Section E, 2014, 70, 51-53
2240112 CIF
HKL
Paper		C11 H19 N7 O7.5 PP 41 21 218.5564; 18.5564; 10.1139
90; 90; 90		3482.6Jasko, Maxim V.; Gurskaya, Galina V.; Kukhanova, Marina K.; Bushmarinov, Ivan S.
Crystal structure of ammonium 3'-azido-3'-deoxythymidine-5'-aminocarbonylphosphonate hemihydrate: an anti-HIV agent
Acta Crystallographica Section E, 2014, 70, 396-399
2240301 CIF
HKL
Paper		C36 H36 N4 O4.75 S2P 41 21 213.3438; 13.3438; 40.237
90; 90; 90		7164.5Yennawar, Hemant P.; Singh, Harnoor; Silverberg, Lee J.
Crystal structure of <i>N</i>-[(2<i>S</i>,5<i>R</i>)-4-oxo-2,3-diphenyl-1,3-thiazinan-5-yl]acetamide 0.375-hydrate
Acta Crystallographica Section E, 2015, 71, 62-64
2241195 CIF
HKL
Paper		C24 H30.78 Mn N2 O10.39P 41 21 28.0953; 8.0953; 37.568
90; 90; 90		2461.98Buvaylo, Elena A.; Vassilyeva, Olga Yu.; Skelton, Brian W.
Crystal structure of bis(2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}-6-methoxyphenolato)manganese(IV) 0.39-hydrate
Acta Crystallographica Section E, 2015, 71, 1307-1310
2242158 CIF
HKL
Paper		C23 H28 N2 O8 SP 41 21 212.9905; 12.9905; 29.942
90; 90; 90		5052.8Wu, Yun-Deng; Liu, Xiao-Hong; Xu, Jian; Zhang, Si-Han; Shen, Kun; Sun, Ling; He, Yong-Mei; Ma, Yan; Zhang, Ai-Hua
Crystal structure of an apremilast ethanol hemisolvate hemihydrate solvatomorph
Acta Crystallographica Section E, 2017, 73, 821-824
2244097 CIF
HKL
Paper		C26 H32 Br N2 O2.5P 41 21 29.9254; 9.9254; 47.1267
90; 90; 90		4642.62Janzen, Daron E.; Butler, Maya S.; Reinheimer, Eric W.
Crystal structures of anhydrous and hydrated <i>N</i>-benzylcinchonidinium bromide
Acta Crystallographica Section E, 2022, 78
2300132 CIF
Paper		C40 H48 O8P 41 21 26.8558; 6.8558; 16.9375
90; 90; 90		796.096Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J.
Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data
Journal of Applied Crystallography, 2007, 40, 702-709
2300251 CIFD2 OP 41 21 26.6748; 6.67484; 6.6838
90; 90; 90		297.78Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Knight, K. S.; Marshall, W. G.; Tucker, M. G.; Fernandez-Alonso, F.
Phase behaviour and thermoelastic properties of perdeuterated ammonia hydrate and ice polymorphs from 0 to 2GPa
Journal of Applied Crystallography, 2009, 42, 846-866
2310644 CIFC3 H12 Cl Cu N6 S3P 41 21 213.41; 13.41; 13.79
90; 90; 90		2479.83Okaya, Y.; Knobler, C.B.
Refinement of the crystal structure of tris(thiourea) copper(I) chloride
Acta Crystallographica (1,1948-23,1967), 1964, 17, 928-930
2310696 CIFP2 ZnP 41 21 25.08; 5.08; 18.59
90; 90; 90		479.741White, J.G.
The crystal structure of the tetragonal modification of Zn P2
Acta Crystallographica (1,1948-23,1967), 1965, 18, 217-220
2312063 CIF
HKL
Paper		C45.25 H55 Ni S4P 41 21 211.7187; 11.7187; 65.014
90; 90; 90		8928.2Das Gupta, Titir; Applebaum, Jack; Broussard, William; Mack, Carson; Wu, Che; Mague, Joel T.; Donahue, James P.
Bis[1,2-bis-(4-<i>tert</i>-butyl-phen-yl)ethyl-ene-1,2-di-thiol-ato(1-)]nickel(II) pentane 0.25-solvate.
Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 182-186
2312483 CIF
Paper		C12 H16 N2 O4P 41 21 211.1312; 11.1312; 10.894
90; 90; 90		1349.8González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector
Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate.
Acta crystallographica. Section C, Structural chemistry, 2024, 80
3000144 On hold until 2018-03-30C20 H14P 41 21 27.0872; 7.0872; 27.477
90; 90; 90		1380.13Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000145 On hold until 2018-03-30C20 H14P 41 21 27.1071; 7.1071; 27.466
90; 90; 90		1387.33Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000146 On hold until 2018-03-30C20 H14P 41 21 27.1316; 7.1316; 27.467
90; 90; 90		1396.96Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000147 On hold until 2018-03-30C20 H14P 41 21 27.1562; 7.1562; 27.473
90; 90; 90		1406.93Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000148 On hold until 2018-03-30C20 H14P 41 21 27.2063; 7.2063; 27.5057
90; 90; 90		1428.39Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000149 On hold until 2018-03-30C20 H14P 41 21 26.8496; 6.8496; 26.691
90; 90; 90		1252.26Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000150 On hold until 2018-03-30C20 H14P 41 21 26.7514; 6.7514; 26.507
90; 90; 90		1208.2Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000151 On hold until 2018-03-30C20 H14P 41 21 26.6809; 6.6809; 26.433
90; 90; 90		1179.82Roszak Kinga; Katrusiak, Andrzej
?
To be published in PCCP
3000625 On hold until 2026-04-21O2 SiP 41 21 27.46237; 7.46237; 8.59612
90; 90; 90		478.692Kanzaki, M.; Xue, X.
Structural and spectroscopic characterization of keatite (SiO2)
To be published in Journal of the Ceramic Society of Japan
3500095 CIF
HKL		C24 H32 O6P 41 21 29.1629; 9.1629; 50.2545
90; 90; 90		4219.3Thierry Maris
Desonide
Personal communication to COD, 2020
4000050 CIFC36 H84 Ga4 O12P 41 21 212.5566; 12.5566; 32.0324
90; 90; 90		5050.5Valet, Murielle; Hoffman, David M.
Synthesis of Homoleptic Gallium Alkoxide Complexes and the Chemical Vapor Deposition of Gallium Oxide Films
Chemistry of Materials, 2001, 13, 2135-2143
4000912 CIFC80 H88 Li N8 O8P 41 21 215.436; 15.436; 28.831
90; 90; 90		6869.6Pandian, Ramasamy P.; Raju, Nandyala P.; Gallucci, Judith C.; Woodward, Patrick M.; Epstein, Arthur J.; Kuppusamy, Periannan
A New Tetragonal Crystalline Polymorph of Lithium Octa-n-Butoxy-Naphthalocyanine (LiNc-BuO) Radical: Structural, Magnetic and Oxygen-Sensing Properties
Chemistry of Materials, 2010, 22, 6254
4001225 CIFC12 H16 Se2 TiP 41 21 29.3965; 9.3965; 14.412
90; 90; 90		1272.5Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael
Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)
Chemistry of Materials, 2008, 20, 5100
4001226 CIFC12 H16 Hf Se2P 41 21 29.5191; 9.5191; 14.604
90; 90; 90		1323.3Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael
Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)
Chemistry of Materials, 2008, 20, 5100
4001229 CIFC18 H28 Se2 ZrP 41 21 210.026; 10.026; 19.288
90; 90; 90		1938.8Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael
Evaluation of Group 4 Metal Bis-cyclopentadienyl Complexes with Selenolate and Tellurolate Ligands for CVD of ME2Films (E = Se or Te)
Chemistry of Materials, 2008, 20, 5100
4002034 CIFH22 N4 O3 S6 Sn2P 41 21 28.56294; 8.56294; 22.7703
90; 90; 90		1669.61Nørby, Peter; Overgaard, Jacob; Christensen, Per S.; Richter, Bo; Song, Xin; Dong, Mingdong; Han, Anpan; Skibsted, Jørgen; Iversen, Bo B.; Johnsen, Simon
(NH4)4Sn2S6·3H2O: Crystal Structure, Thermal Decomposition, and Precursor for Textured Thin Film
Chemistry of Materials, 2014, 26, 4494
4002658 CIFAl Li O2P 41 21 25.1965; 5.1965; 6.3464
90; 90; 90		171.376Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin
Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers
Chemistry of Materials, 2016, 28, 915
4002659 CIFAl Li O2P 41 21 25.15885; 5.15885; 6.27
90; 90; 90		166.868Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin
Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers
Chemistry of Materials, 2016, 28, 915
4002660 CIFAl Li O2P 41 21 25.2252; 5.2252; 6.4038
90; 90; 90		174.841Wiedemann, Dennis; Nakhal, Suliman; Rahn, Johanna; Witt, Elena; Islam, Mazharul M.; Zander, Stefan; Heitjans, Paul; Schmidt, Harald; Bredow, Thomas; Wilkening, Martin; Lerch, Martin
Unravelling Ultraslow Lithium-Ion Diffusion in γ-LiAlO2: Experiments with Tracers, Neutrons, and Charge Carriers
Chemistry of Materials, 2016, 28, 915
4003642 CIFC H6 Au Br3 NP 41 21 27.9115; 7.9115; 23.385
90; 90; 90		1463.7Ghosh, Biplab; Febriansyah, Benny; Harikesh, Padinhare Cholakkal; Koh, Teck Ming; Hadke, Shreyash; Wong, Lydia H.; England, Jason; Mhaisalkar, Subodh G.; Mathews, Nripan
Direct Band Gap Mixed-Valence Organic‒inorganic Gold Perovskite as Visible Light Absorbers
Chemistry of Materials, 2020
4020037 CIFC40 H56 Fe2 I2 N2 O2 Pd2 Si2P 41 21 212.5501; 12.5501; 29.4265
90; 90; 90		4634.8Carolyn E. Anderson; Yariv Donde; Christopher J. Douglas; Larry E. Overman
Journal of Organic Chemistry, 2005, 70, 648-657
4021205 CIFC15 H19 N OP 41 21 26.5986; 6.5986; 53.743
90; 90; 90		2340Daniele Casarini; Carmine Coluccini; Lodovico Lunazzi; Andrea Mazzanti; Romina Rompietti
Conformational Studies by Dynamic NMR. 100. Enantiomerization Process of Stereolabile Atropisomers in Pyridine-Substituted Adamantane Derivatives
Journal of Organic Chemistry, 2004, 69, 5746-5748
4021283 CIFC47 H55 Cl2 N2 O5 P2 RhP 41 21 210.495; 10.495; 42.528
90; 90; 90		4684.1Yu Fu; Xun-Xiang Guo; Shou-Fei Zhu; Ai-Guo Hu; Jian-Hua Xie; Qi-Lin Zhou
Rhodium-Catalyzed Asymmetric Hydrogenation of Functionalized Olefins Using Monodentate Spiro Phosphoramidite Ligands
Journal of Organic Chemistry, 2004, 69, 4648-4655

Blue left arrow Blue left arrow First | Blue left arrow Previous 100 | of 10 | Next 100 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!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.