Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section E' volume of publication is 73

COD ID: 2020683
CIF file

HKL data

Original IUCr paper

Formula: - C21 H18 Br2 N4 O3 -
Comments: Wang, Bang Zhong; Zhou, Jun Ping; Zhou, Yong; Luo, Jian Song; Yang, Jun Jie; Chi, Shao M.ing Crystal structure of <i>N</i>-(7-dibromomethyl-5-methyl-1,8-naphthyridin-2-yl)benzamide‒pyrrolidine-2,5-dione (1/1) Acta Crystallographica Section E 73(1) (2017) 1-3
Space group: P 1 21/c 1
Cell volume: 2102.8
Cell parameters: 9.6931; 15.699; 14.614; 90; 108.99; 90;  

COD ID: 2020703
CIF file

HKL data

Formula: - C21 H26 N4 O5 -
Comments: Faizi, Md. Serajul Haque; Dege, Necmi; Haque, Ashanul; Kalibabchuk, Valentina A.; Cemberci, Mustafa Crystal structure of (E)-2,6-di-tert-butyl-4-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}phenol Acta Crystallographica Section E Crystallographic Communications 73(2) (2017) 96
Space group: P n m a
Cell volume: 2240.9
Cell parameters: 18.7651; 6.9193; 17.259; 90; 90; 90;  

COD ID: 2020739
CIF file

HKL data

Original IUCr paper

Formula: - C26 H20 Fe N10 O2 S2 -
Comments: Jochim, Aleksej; Jess, Inke; Näther, Christian Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate Acta Crystallographica Section E Crystallographic Communications 73(4) (2017) 463
Space group: P 1 21/c 1
Cell volume: 1565.88
Cell parameters: 8.5376; 15.22; 12.1214; 90; 96.195; 90;  

COD ID: 2020828
CIF file

HKL data

Formula: - C18 H20 N6 O4 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen Crystal structure of a pyrazine-2,3-dicarboxamide ligand and of its silver(I) nitrate complex, a three-dimensional coordination polymer Acta Crystallographica Section E Crystallographic Communications 73(6) (2017) 798
Space group: P 1 c 1
Cell volume: 924.5
Cell parameters: 4.3677; 14.0232; 15.1816; 90; 96.153; 90;  

COD ID: 2020829
CIF file

HKL data

Formula: - C18 H16 Ag N7 O5 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen Crystal structure of a pyrazine-2,3-dicarboxamide ligand and of its silver(I) nitrate complex, a three-dimensional coordination polymer Acta Crystallographica Section E Crystallographic Communications 73(6) (2017) 798
Space group: F d d d
Cell volume: 7672.1
Cell parameters: 14.9776; 17.3228; 29.57; 90; 90; 90;  

COD ID: 2020830
CIF file

HKL data

Formula: - C13 H9 Br N2 O5 S -
Comments: Naveen, S.; Sudha, A. G.; Suresha, E.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M. Crystal structures of isomeric 4-bromo-N-[(2-nitrophenyl)sulfonyl]benzamide and 4-bromo-N-[(4-nitrophenyl)sulfonyl]benzamide Acta Crystallographica Section E Crystallographic Communications 73(3) (2017) 314
Space group: P 1 21/n 1
Cell volume: 2882.96
Cell parameters: 8.0209; 14.5364; 25.0008; 90; 98.499; 90;  

COD ID: 2020831
CIF file

HKL data

Formula: - C13 H9 Br N2 O5 S -
Comments: Naveen, S.; Sudha, A. G.; Suresha, E.; Lokanath, N. K.; Suchetan, P. A.; Abdoh, M. Crystal structures of isomeric 4-bromo-N-[(2-nitrophenyl)sulfonyl]benzamide and 4-bromo-N-[(4-nitrophenyl)sulfonyl]benzamide Acta Crystallographica Section E Crystallographic Communications 73(3) (2017) 314
Space group: P b c a
Cell volume: 2750.9
Cell parameters: 9.6085; 10.3246; 27.7296; 90; 90; 90;  

COD ID: 2020839
CIF file

HKL data

Original IUCr paper

Formula: - C17 H17 Cl4 N5 O2 S -
Comments: Riyadh, Sayed; Hughes, David L.; Said, Musa A. Crystal structure of a 1,1,2,2-tetrachloroethane-solvated hydrazinecarbothioamide compound Acta Crystallographica Section E Crystallographic Communications 73(9) (2017) 1271
Space group: P 1 21/c 1
Cell volume: 2104.02
Cell parameters: 5.9124; 17.6155; 20.3351; 90; 96.563; 90;  

COD ID: 2020877
CIF file

HKL data

Original IUCr paper

Formula: - C36 H32 N14 O6 Zn -
Comments: Liu, Fuhong; Ding, Yan; Li, Qiuyu; Zhang, Liping A two-dimensional Zn coordination polymer with a three-dimensional supramolecular architecture Acta Crystallographica Section E Crystallographic Communications 73(10) (2017) 1402
Space group: P -1
Cell volume: 935.4
Cell parameters: 7.3257; 9.0188; 15.578; 81.7; 77.64; 68.9;  

COD ID: 2241969
CIF file

HKL data

Formula: - C48 H56 N4 O4 Sn2 -
Comments: Carlos, Camacho-Camacho; Naytzé, Ortiz-Pastrana; Ariadna, Garza-Ortiz; Irma, Rojas-Oviedo Crystal structure of bis{μ-(<i>E</i>)-2-[(2-oxidophenylimino)methyl]quinolin-8-olato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}bis[dibutyltin(IV)] Acta Crystallographica Section E 73(1) (2017) 4-7
Space group: P -1
Cell volume: 2202.4
Cell parameters: 13.4874; 13.7517; 13.8397; 89.48; 80.345; 60.858;  

COD ID: 2241973
CIF file

HKL data

Formula: - C34 H26 F2 O6 -
Comments: Mohamed, Shaaban K.; Akkurt, Mehmet; Hawaiz, Farouq E.; Ayoob, Mzgin M.; Hosten, Eric Crystal structure of (6<i>E</i>,20<i>E</i>)-3,24-difluoro-13,14,28,29-tetrahydro-5<i>H</i>,22<i>H</i>-tetrabenzo[<i>e</i>,<i>j</i>,<i>p</i>,<i>u</i>][1,4,12,15]tetraoxacyclodocosine-5,22-dione Acta Crystallographica Section E 73(1) (2017) 13-16
Space group: P 1 21/c 1
Cell volume: 2776.2
Cell parameters: 16.2618; 11.6708; 14.7359; 90; 96.945; 90;  

COD ID: 2241974
CIF file

HKL data

Original IUCr paper

Formula: - C108 H76 N28 Ni2 O6 -
Comments: Černák, Juraj; Kuchár, Juraj; Hegedüs, Michal Disorder of the dimeric TCNQ‒TCNQ unit in the crystal structure of [Ni(bpy)~3~]~2~(TCNQ‒TCNQ)(TCNQ)~2~·6H~2~O (TCNQ is 7,7,8,8-tetracyanoquinodimethane) Acta Crystallographica Section E 73(1) (2017) 8-12
Space group: P -1
Cell volume: 2444.21
Cell parameters: 12.4034; 13.2921; 15.4869; 88.828; 86.336; 73.586;  

COD ID: 2241975
CIF file

HKL data

Original IUCr paper

Formula: - C11 H13 N3 O2 S -
Comments: Viswanathan, Vijayan; Ananth, Mani Karthik; Narasimhan, S.; Velmurugan, Devadasan Crystal structures of (<i>E</i>)-4-[1-(2-carbamothioylhydrazinylidene)ethyl]phenyl acetate and (<i>E</i>)-4-[1-(2-carbamothioylhydrazinylidene)ethyl]phenyl benzoate Acta Crystallographica Section E 73(1) (2017) 20-23
Space group: P -1
Cell volume: 1255.3
Cell parameters: 7.8783; 8.9254; 18.7372; 77.243; 82.423; 78.856;  

COD ID: 2241976
CIF file

HKL data

Original IUCr paper

Formula: - C16 H15 N3 O2 S -
Comments: Viswanathan, Vijayan; Ananth, Mani Karthik; Narasimhan, S.; Velmurugan, Devadasan Crystal structures of (<i>E</i>)-4-[1-(2-carbamothioylhydrazinylidene)ethyl]phenyl acetate and (<i>E</i>)-4-[1-(2-carbamothioylhydrazinylidene)ethyl]phenyl benzoate Acta Crystallographica Section E 73(1) (2017) 20-23
Space group: P -1
Cell volume: 761.05
Cell parameters: 7.8145; 9.7538; 10.905; 78.855; 69.031; 84.2;  

COD ID: 2241977
CIF file

HKL data

Original IUCr paper

Formula: - C22 H21 N5 S2 Zn -
Comments: Lee, Dong Won; Shin, Jong Won Crystal structure of {(<i>S</i>)-1-phenyl-<i>N</i>,<i>N</i>-bis[(pyridin-2-yl)methyl]ethanamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}bis(thiocyanato-κ<i>N</i>)zinc from synchrotron data Acta Crystallographica Section E 73(1) (2017) 17-19
Space group: C 1 2 1
Cell volume: 2227.2
Cell parameters: 19.27; 7.795; 14.834; 90; 91.71; 90;  

COD ID: 2241978
CIF file

HKL data

Original IUCr paper

Formula: - C36 H34 N12 Na2 O12 -
Comments: Safyanova, Inna S.; Ohui, Kateryna A.; Omelchenko, Irina V. Crystal structure of bis(μ-<i>N</i>-hydroxypicolinamidato)bis[bis(<i>N</i>-hydroxypicolinamide)sodium] Acta Crystallographica Section E 73(1) (2017) 24-27
Space group: P -1
Cell volume: 948.02
Cell parameters: 9.7997; 10.0959; 11.0401; 96.618; 102.741; 113.902;  

COD ID: 2241979
CIF file

HKL data

Original IUCr paper

Formula: - C8 H20 Cl2 Cu N4 O8 -
Comments: Gray, Jessica L.; Gerlach, Deidra L.; Papish, Elizabeth T. Crystal structure of (perchlorato-κ<i>O</i>)(1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>)copper(II) perchlorate Acta Crystallographica Section E 73(1) (2017) 31-34
Space group: P 1 21/n 1
Cell volume: 1603.05
Cell parameters: 8.9387; 15.0607; 11.9235; 90; 92.949; 90;  

COD ID: 2241980
CIF file

HKL data

Original IUCr paper

Formula: - C58 H43.62 Cd2 Cl2 N16 O2.81 -
Comments: Setifi, Fatima; Morgenstern, Bernd; Hegetschweiler, Kaspar; Setifi, Zouaoui; Touzani, Rachid; Glidewell, Christopher Crystal structure of <i>meso</i>-di-μ-chlorido-bis[bis(2,2'-bipyridine)cadmium] bis(1,1,3,3-tetracyano-2-ethoxypropenide) 0.81-hydrate Acta Crystallographica Section E 73(1) (2017) 48-52
Space group: P 1 21/c 1
Cell volume: 2910.3
Cell parameters: 12.425; 13.912; 17.382; 90; 104.395; 90;  

COD ID: 2241981
CIF file

HKL data

Original IUCr paper

Formula: - C24 H21 Cl N2 O -
Comments: Mohamed, Shaaban K.; Marzouk, Adel A.; Albayati, Mustafa R.; Abdelhamid, Antar A.; Simpson, Jim Crystal structure of 1-[2-(4-chlorophenyl)-4,5-diphenyl-1<i>H</i>-imidazol-1-yl]propan-2-ol Acta Crystallographica Section E 73(1) (2017) 59-62
Space group: P -1
Cell volume: 2039.2
Cell parameters: 12.0235; 13.4263; 13.6588; 90.297; 98.481; 110.48;  

COD ID: 2241982
CIF file

Original IUCr paper

Formula: - C23 H29 N3 O -
Comments: Faizi, Md. Serajul Haque; Ahmad, Musheer; Kapshuk, Anatoly A.; Golenya, Irina A. Crystal structure of (<i>E</i>)-9-({[4-(diethylamino)phenyl]imino}methyl)-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-pyrido[3,2,1-<i>ij</i>]quinolin-8-ol Acta Crystallographica Section E 73(1) (2017) 38-40
Space group: P 1 21/c 1
Cell volume: 1906.7
Cell parameters: 11.565; 8.0504; 20.665; 90; 97.68; 90;  

COD ID: 2241983
CIF file

HKL data

Original IUCr paper

Formula: - C21 H14 N2 O2 -
Comments: Samundeeswari, S.; Kulkarni, Manohar V.; Anil Kumar, G. N. Crystal structure of 4-(4b,8a-dihydro-9<i>H</i>-pyrido[3,4-<i>b</i>]indol-1-yl)-7-methyl-2<i>H</i>-chromen-2-one Acta Crystallographica Section E 73(1) (2017) 56-58
Space group: P 1 21/c 1
Cell volume: 1532.2
Cell parameters: 10.6784; 8.0954; 17.9032; 90; 98.105; 90;  

COD ID: 2241984
CIF file

HKL data

Original IUCr paper

Formula: - C43 H37 Cl Cu N3 O2 P2 S -
Comments: Nimthong-Roldán, Arunpatcha; Promsuwhan, Nichakan; Puetpaiboon, Walailak; Wattanakanjana, Yupa Crystal structure of chlorido[1-(4-nitrophenyl)thiourea-κ<i>S</i>]bis(triphenylphosphane-κ<i>P</i>)copper(I) Acta Crystallographica Section E 73(1) (2017) 41-44
Space group: P 1 21/c 1
Cell volume: 3828.28
Cell parameters: 11.6986; 28.7847; 11.8471; 90; 106.339; 90;  

COD ID: 2241985
CIF file

HKL data

Original IUCr paper

Formula: - C16 H9 Cl O4 -
Comments: Ziki, Eric; Sosso, Siaka; Mansilla-Koblavi, Frédérica; Djandé, Abdoulaye; Kakou-Yao, Rita Crystal structure of 2-oxo-2<i>H</i>-chromen-3-yl 4-chlorobenzoate and Hirshfeld surface analysis Acta Crystallographica Section E 73(1) (2017) 45-47
Space group: P -1
Cell volume: 655.75
Cell parameters: 6.7866; 7.1789; 14.0981; 94.098; 93.461; 106.154;  

COD ID: 2241986
CIF file

HKL data

Formula: - C12 H22 Cu I N2 O2 S2 -
Comments: Chiang, Hojae; Kim, Tae Ho; Park, Hyunjin; Kim, Jineun Crystal structure of <i>catena</i>-poly[[bis(<i>N</i>-acethylthiomorpholine-κ<i>S</i>)copper(I)]-μ-iodido] Acta Crystallographica Section E 73(1) (2017) 53-55
Space group: P 1 21/n 1
Cell volume: 1679.34
Cell parameters: 14.1513; 7.6557; 16.9423; 90; 113.805; 90;  

COD ID: 2241987
CIF file

HKL data

Original IUCr paper

Formula: - C13 H12 Cl N5 -
Comments: Repich, Hlib; Orysyk, Svitlana; Savytskyi, Pavlo; Pekhnyo, Vasyl Synthesis and crystal structure of <i>N</i>-(4-chlorophenyl)-5,7-dimethyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-2-amine Acta Crystallographica Section E 73(1) (2017) 35-37
Space group: P 1 21/n 1
Cell volume: 1252.97
Cell parameters: 7.064; 25.2362; 7.6494; 90; 113.243; 90;  

COD ID: 2241988
CIF file

HKL data

Original IUCr paper

Formula: - C36 H52 Cl4 Co N2 O2 -
Comments: Gauchat, Eric; Nazarenko, Alexander Y. Crystal structures of bis[(9<i>S</i>,13<i>S</i>,14<i>S</i>)-3-methoxy-17-methylmorphinanium] tetrachloridocobaltate and tetrachloridocuprate Acta Crystallographica Section E 73(1) (2017) 63-67
Space group: C 1 2 1
Cell volume: 1852.68
Cell parameters: 13.8447; 9.2316; 14.7018; 90; 99.605; 90;  

COD ID: 2241989
CIF file

HKL data

Formula: - C36 H52 Cl4 Cu N2 O2 -
Comments: Gauchat, Eric; Nazarenko, Alexander Y. Crystal structures of bis[(9<i>S</i>,13<i>S</i>,14<i>S</i>)-3-methoxy-17-methylmorphinanium] tetrachloridocobaltate and tetrachloridocuprate Acta Crystallographica Section E 73(1) (2017) 63-67
Space group: C 1 2 1
Cell volume: 1855.1
Cell parameters: 13.8066; 9.2934; 14.651; 90; 99.318; 90;  

COD ID: 2241990
CIF file

HKL data

Original IUCr paper

Formula: - C12 H15 N O3 S -
Comments: Hernández, Yaiza; Marcos, Isidro; Garrido, Narciso M.; Sanz, Francisca; Diez, David Crystal structure of (2<i>R</i>*,3a<i>R</i>*)-2-phenylsulfonyl-2,3,3a,4,5,6-hexahydropyrrolo[1,2-<i>b</i>]isoxazole Acta Crystallographica Section E 73(1) (2017) 85-87
Space group: P 1 21/c 1
Cell volume: 1236.22
Cell parameters: 12.573; 5.4443; 18.2266; 90; 97.754; 90;  

COD ID: 2241991
CIF file

HKL data

Original IUCr paper

Formula: - C24 H50 Cr4 N12 O8 S4 -
Comments: Moon, Dohyun; Takase, Masahiro; Akitsu, Takashiro; Choi, Jong-Ha Crystal structure of bis[<i>cis</i>-(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)(thiocyanato-κ<i>N</i>)chromium(III)] dichromate monohydrate from synchrotron X-ray diffraction data Acta Crystallographica Section E 73(1) (2017) 72-75
Space group: C 1 2/c 1
Cell volume: 3907.8
Cell parameters: 16.044; 16.221; 15.041; 90; 93.335; 90;  

COD ID: 2241992
CIF file

HKL data

Original IUCr paper

Formula: - C18 H26 O4 -
Comments: Macías, Mario A.; Pandolfi, Enrique; Schapiro, Valeria; Silveira, Gustavo P.; Vilela, Guilherme D.; Suescun, Leopoldo Crystal structure and absolute configuration of (3a<i>R</i>,3'a<i>R</i>,7a<i>S</i>,7'a<i>S</i>)-2,2,2',2'-tetramethyl-3a,6,7,7a,3'a,6',7',7'a-octahydro-4,4'-bi[1,3-benzodioxolyl], obtained from a Pd-catalyzed homocoupling reaction Acta Crystallographica Section E 73(1) (2017) 81-84
Space group: P 1 21 1
Cell volume: 822.89
Cell parameters: 6.2927; 17.9903; 7.2991; 90; 95.216; 90;  

COD ID: 2241993
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 Fe I N O2 Pd -
Comments: Verpekin, Victor V.; Kreindlin, Arkadii Z.; Semeikin, Oleg V.; Smol'yakov, Alexander F.; Dolgushin, Fedor M.; Chudin, Oleg S.; Ustynyuk, Nikolai A. Crystal structure of μ-carbonyl-1:2κ^2^<i>C</i>:<i>C</i>-carbonyl-1κ<i>C</i>-(1η^5^-cyclopentadienyl)iodido-2κ<i>I</i>-[μ-2-(pyridin-2-yl)ethene-1,1-diyl-1κ<i>C</i>^1^:2κ^2^<i>N</i>,<i>C</i>^1^]ironpalladium(<i>Fe</i>—<i>Pd</i>) benzene monosolvate Acta Crystallographica Section E 73(1) (2017) 68-71
Space group: P 1 21/c 1
Cell volume: 1885
Cell parameters: 14.3058; 9.0983; 14.7315; 90; 100.553; 90;  

COD ID: 2241994
CIF file

HKL data

Original IUCr paper

Formula: - C28 H41 Cl3 O3 Ti -
Comments: Kim, Yun Young; Tanski, Joseph M. Crystal structure of a rare trigonal bipyramidal titanium(IV) coordination complex: trichlorido(3,3'-di-<i>tert</i>-butyl-2'-hydroxy-5,5',6,6'-tetramethyl-1,1'-biphenyl-2-olato-κ<i>O</i>^2^)(tetrahydrofuran-κ<i>O</i>)titanium(IV) Acta Crystallographica Section E 73(1) (2017) 88-91
Space group: P 1 21 1
Cell volume: 2951
Cell parameters: 10.289; 7.141; 40.33; 90; 95.164; 90;  

COD ID: 2241995
CIF file

HKL data

Formula: - C12 H32 N2 O6 P2 -
Comments: Reiss, Guido J.; van Megen, Martin; Frank, Walter Hydrogen bonds and van der Waals forces as tools for the construction of a herringbone pattern in the crystal structure of hexane-1,6-diaminium hexane-1,6-diyl bis(hydrogen phosphonate) Acta Crystallographica Section E 73(1) (2017) 76-80
Space group: P 1 21/c 1
Cell volume: 913.33
Cell parameters: 5.88242; 20.2162; 7.7574; 90; 98.09; 90;  

COD ID: 2241996
CIF file

HKL data

Original IUCr paper

Formula: - C50 H44 -
Comments: Kamata, Sho; Sato, Sota; Wu, Jishan; Isobe, Hiroyuki Crystal structure of 7,15-bis(4-<i>tert</i>-butylphenyl)-1,9-dimethylheptazethrene Acta Crystallographica Section E 73(2) (2017) 99-102
Space group: P -1
Cell volume: 894.47
Cell parameters: 8.7644; 9.2002; 13.1212; 105.874; 95.08; 115.249;  

COD ID: 2241997
CIF file

HKL data

Formula: - C21 H36 O3 -
Comments: Martínez, Andrea; Santalla, Hugo; Garrido, Fátima; Barry, Aliou Hamady; Gaye, Mohamed; Fall Diop, Yagamare Crystal structure of (1<i>R</i>,3a<i>R</i>,7a<i>R</i>)-1-{(<i>S</i>)-1-[(2<i>R</i>,5<i>S</i>)-5-(3-hydroxypentan-3-yl)tetrahydrofuran-2-yl]ethyl}-7a-methyl-2,3,3a,4,5,6,7,7a-octahydro-1<i>H</i>-inden-4-one Acta Crystallographica Section E 73(2) (2017) 115-117
Space group: P 1 21 1
Cell volume: 979.32
Cell parameters: 9.4601; 6.3779; 16.7425; 90; 104.196; 90;  

COD ID: 2241998
CIF file

HKL data

Original IUCr paper

Formula: - C19 H15 N3 O3 -
Comments: Faizi, Md. Serajul Haque; Haque, Ashanul; Kalibabchuk, Valentina A. Crystal structure of (<i>E</i>)-2-{[(4-anilinophenyl)imino]methyl}-4-nitrophenol Acta Crystallographica Section E 73(2) (2017) 112-114
Space group: P 1 21/n 1
Cell volume: 1538.3
Cell parameters: 6.4243; 31.818; 7.6595; 90; 100.736; 90;  

COD ID: 2241999
CIF file

HKL data

Original IUCr paper

Formula: - C24 H29 N O4 -
Comments: Nguyen, Van Tuyen; Truong, Hong Hieu; Le, Tuan Anh; Soldatenkov, Anatoly T.; Thi, Tuyet Anh Dang; Tran, Thi Thanh Van; Esina, Natalia Ya.; Khrustalev, Victor N. Crystal structure of 22,24,25-trimethyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0^2,7^.0^15,20^]pentacosa-2,4,6,15(20),16,18-hexaen-23-one Acta Crystallographica Section E 73(2) (2017) 118-121
Space group: P n m a
Cell volume: 1991.1
Cell parameters: 8.1468; 20.3402; 12.0155; 90; 90; 90;  

COD ID: 2242000
CIF file

HKL data

Original IUCr paper

Formula: - C32 H53 Br2 Li2 N3 O2 -
Comments: Pedziwiatr, Jakub; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Crystal structures of a novel NNN pincer ligand and its dinuclear titanium(IV) alkoxide pincer complex Acta Crystallographica Section E 73(2) (2017) 122-126
Space group: P b c n
Cell volume: 3556.8
Cell parameters: 11.8301; 22.3946; 13.4254; 90; 90; 90;  

COD ID: 2242001
CIF file

HKL data

Formula: - C97.5 H140 Br2 Li2 N6 O6 Ti2 -
Comments: Pedziwiatr, Jakub; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. Crystal structures of a novel NNN pincer ligand and its dinuclear titanium(IV) alkoxide pincer complex Acta Crystallographica Section E 73(2) (2017) 122-126
Space group: P -1
Cell volume: 2235.49
Cell parameters: 12.2546; 12.724; 15.9477; 75.8613; 68.0449; 83.22;  

COD ID: 2242002
CIF file

HKL data

Original IUCr paper

Formula: - C18 H18 Cl N O -
Comments: Arulraj, R.; Sivakumar, S.; Kaur, Manpreet; Thiruvalluvar, A.; Jasinski, Jerry P. Crystal structures of three 3-chloro-3-methyl-2,6-diarylpiperidin-4-ones Acta Crystallographica Section E 73(2) (2017) 107-111
Space group: P -1
Cell volume: 756.79
Cell parameters: 6.715; 10.9591; 11.1704; 72.162; 79.721; 76.873;  

COD ID: 2242003
CIF file

HKL data

Formula: - C20 H22 Cl N O -
Comments: Arulraj, R.; Sivakumar, S.; Kaur, Manpreet; Thiruvalluvar, A.; Jasinski, Jerry P. Crystal structures of three 3-chloro-3-methyl-2,6-diarylpiperidin-4-ones Acta Crystallographica Section E 73(2) (2017) 107-111
Space group: P n a 21
Cell volume: 1756.19
Cell parameters: 13.0578; 22.6513; 5.93756; 90; 90; 90;  

COD ID: 2242004
CIF file

HKL data

Formula: - C18 H16 Cl3 N O -
Comments: Arulraj, R.; Sivakumar, S.; Kaur, Manpreet; Thiruvalluvar, A.; Jasinski, Jerry P. Crystal structures of three 3-chloro-3-methyl-2,6-diarylpiperidin-4-ones Acta Crystallographica Section E 73(2) (2017) 107-111
Space group: P n a 21
Cell volume: 1725.88
Cell parameters: 13.243; 22.3945; 5.81947; 90; 90; 90;  

COD ID: 2242005
CIF file

HKL data

Original IUCr paper

Formula: - C34 H26 Cl2 N8 Ni O6 -
Comments: Nakanishi, Takumi; Sato, Osamu Crystal structures of two nickel compounds comprising neutral Ni^II^ hydrazone complexes and dicarboxylic acids Acta Crystallographica Section E 73(2) (2017) 103-106
Space group: P -1
Cell volume: 1616
Cell parameters: 7.9596; 8.76; 24.121; 76.138; 81.803; 87.253;  

COD ID: 2242006
CIF file

HKL data

Original IUCr paper

Formula: - C34 H26 Br2 N8 Ni O6 -
Comments: Nakanishi, Takumi; Sato, Osamu Crystal structures of two nickel compounds comprising neutral Ni^II^ hydrazone complexes and dicarboxylic acids Acta Crystallographica Section E 73(2) (2017) 103-106
Space group: P -1
Cell volume: 1637.3
Cell parameters: 7.874; 8.9716; 24.233; 75.04; 82.162; 86.007;  

COD ID: 2242007
CIF file

HKL data

Original IUCr paper

Formula: - C27 H20 N2 -
Comments: Faizi, Md. Serajul Haque; Haque, Ashanul; Ahmad, Musheer; Golenya, Irina A. Crystal structure of (<i>E</i>)-<i>N</i>^1^-[(anthracen-9-yl)methylidene]-<i>N</i>^4^-phenylbenzene-1,4-diamine Acta Crystallographica Section E 73(2) (2017) 137-140
Space group: P 1 21/c 1
Cell volume: 5805.6
Cell parameters: 11.1554; 45.224; 11.5856; 90; 96.645; 90;  

COD ID: 2242008
CIF file

HKL data

Formula: - C39 H37 Cl F6 Ir N7 O6 S2 -
Comments: Smith, Victoria I.; Nozari, Mohammad; Zeller, Matthias; Addison, Anthony W. Crystal structure of (2,2'-bipyridyl)[2,6-bis(1-butyl-1<i>H</i>-benzimidazol-2-yl)pyridine]chloridoiridium(III) trifluoromethanesulfonate Acta Crystallographica Section E 73(2) (2017) 127-132
Space group: P -1
Cell volume: 2131.96
Cell parameters: 10.7731; 13.1932; 17.0021; 104.53; 96.3822; 110.836;  

COD ID: 2242009
CIF file

HKL data

Original IUCr paper

Formula: - C12 H20 N4 O5 -
Comments: Piccialli, Vincenzo; Borbone, Nicola; Oliviero, Giorgia; Piccialli, Gennaro; D'Errico, Stefano; Centore, Roberto 5-Amino-1-(2',3'-<i>O</i>-isopropylidene-<small>D</small>-ribityl)-1<i>H</i>-imidazole-4-carboxamide: a crystal structure with <i>Z</i>' = 4 Acta Crystallographica Section E 73(2) (2017) 183-187
Space group: P 1 21 1
Cell volume: 2873.9
Cell parameters: 11.627; 18.929; 13.085; 90; 93.67; 90;  

COD ID: 2242010
CIF file

HKL data

Original IUCr paper

Formula: - C54 H108 N6 O18 Rb4 Sn9 -
Comments: Klein, Wilhelm; He, Haiyan; Fässler, Thomas F. Crystal structure of tris[(4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane-κ^8^<i>N</i>~2~,<i>O</i>~6~)rubidium] rubidium nonastannide Acta Crystallographica Section E 73(2) (2017) 147-151
Space group: P -1
Cell volume: 4165.4
Cell parameters: 15.7287; 16.153; 20.2896; 98.782; 104.35; 118.407;  

COD ID: 2242011
CIF file

HKL data

Formula: - C49 H48 Br Cl2 Fe2 N P2 -
Comments: Zirakzadeh, Afrooz; Stöger, Berthold; Kirchner, Karl Crystal structure of bis{(<i>S</i>)-1-[2-(diphenylphosphanyl)ferrocenyl]-(<i>R</i>)-ethyl}ammonium bromide dichloromethane monosolvate Acta Crystallographica Section E 73(2) (2017) 152-154
Space group: P 43
Cell volume: 4292.5
Cell parameters: 11.2463; 11.2463; 33.938; 90; 90; 90;  

COD ID: 2242012
CIF file

HKL data

Formula: - C14 H10 N4 O3 -
Comments: Velasques, Jecika Maciel; Gervini, Vanessa Carratu; Bortoluzzi, Adaílton João; de Farias, Renan Lira; de Oliveira, Adriano Bof Crystal structure of (3<i>E</i>)-5-nitro-3-(2-phenylhydrazinylidene)-1<i>H</i>-indol-2(3<i>H</i>)-one Acta Crystallographica Section E 73(2) (2017) 168-172
Space group: P -1
Cell volume: 617.69
Cell parameters: 5.7504; 9.719; 12.1976; 111.196; 96.759; 98.497;  

COD ID: 2242013
CIF file

HKL data

Original IUCr paper

Formula: - C28 H24 O6 -
Comments: Gopinath, S.; Narayanan, P.; Sethusankar, K.; Karunakaran, Jeyachandran; Nandakumar, Meganathan; Mohanakrishnan, Arasambattu K. Crystal structures of three 1-oxo-1,2-dihydronaphthalene derivatives: dimethyl 4-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxo-1,2-dihydronaphthalene-2,3-dicarboxylate, dimethyl 1-oxo-2-(pyren-4-yl)-4-(thiophen-2-yl)-1,2-dihydronaphthalene-2,3-dicarboxylate and ethyl 1-oxo-2-phenyl-2,4-bis(thiophen-2-yl)-1,2-dihydronaphthalene-3-carboxylate Acta Crystallographica Section E 73(2) (2017) 177-182
Space group: P -1
Cell volume: 1170.07
Cell parameters: 7.5256; 10.2095; 15.6299; 93.99; 94.679; 101.089;  

COD ID: 2242014
CIF file

HKL data

Original IUCr paper

Formula: - C34 H22 O5 S -
Comments: Gopinath, S.; Narayanan, P.; Sethusankar, K.; Karunakaran, Jeyachandran; Nandakumar, Meganathan; Mohanakrishnan, Arasambattu K. Crystal structures of three 1-oxo-1,2-dihydronaphthalene derivatives: dimethyl 4-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxo-1,2-dihydronaphthalene-2,3-dicarboxylate, dimethyl 1-oxo-2-(pyren-4-yl)-4-(thiophen-2-yl)-1,2-dihydronaphthalene-2,3-dicarboxylate and ethyl 1-oxo-2-phenyl-2,4-bis(thiophen-2-yl)-1,2-dihydronaphthalene-3-carboxylate Acta Crystallographica Section E 73(2) (2017) 177-182
Space group: P 1 21/n 1
Cell volume: 2537.9
Cell parameters: 10.9268; 18.967; 12.2628; 90; 93.03; 90;  

COD ID: 2242015
CIF file

HKL data

Original IUCr paper

Formula: - C27 H20 O3 S2 -
Comments: Gopinath, S.; Narayanan, P.; Sethusankar, K.; Karunakaran, Jeyachandran; Nandakumar, Meganathan; Mohanakrishnan, Arasambattu K. Crystal structures of three 1-oxo-1,2-dihydronaphthalene derivatives: dimethyl 4-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxo-1,2-dihydronaphthalene-2,3-dicarboxylate, dimethyl 1-oxo-2-(pyren-4-yl)-4-(thiophen-2-yl)-1,2-dihydronaphthalene-2,3-dicarboxylate and ethyl 1-oxo-2-phenyl-2,4-bis(thiophen-2-yl)-1,2-dihydronaphthalene-3-carboxylate Acta Crystallographica Section E 73(2) (2017) 177-182
Space group: P 1 21/c 1
Cell volume: 2262.8
Cell parameters: 12.1263; 11.8009; 16.0657; 90; 100.181; 90;  

COD ID: 2242016
CIF file

HKL data

Original IUCr paper

Formula: - C21 H31 N6 Ni O9 S -
Comments: Zhong, Kai-Long A new one-dimensional Ni^II^ coordination polymer with a two-dimensional supramolecular architecture Acta Crystallographica Section E 73(2) (2017) 192-195
Space group: P -1
Cell volume: 1255.53
Cell parameters: 8.691; 11.7296; 13.12; 83.922; 77.829; 74.064;  

COD ID: 2242017
CIF file

HKL data

Original IUCr paper

Formula: - C8 H12 Cl4 N4 O5 Zn -
Comments: Martens, Sean J.; Geiger, David K. Structural characterization of two tetrachloridozincate salts of 4-carboxy-1<i>H</i>-imidazol-3-ium: a salt hydrate and a co-crystal salt hydrate Acta Crystallographica Section E 73(2) (2017) 162-167
Space group: P -1
Cell volume: 840.7
Cell parameters: 6.9094; 7.5828; 16.468; 79.455; 84.489; 83.833;  

COD ID: 2242018
CIF file

HKL data

Original IUCr paper

Formula: - C16 H20 Cl4 N8 O9 Zn -
Comments: Martens, Sean J.; Geiger, David K. Structural characterization of two tetrachloridozincate salts of 4-carboxy-1<i>H</i>-imidazol-3-ium: a salt hydrate and a co-crystal salt hydrate Acta Crystallographica Section E 73(2) (2017) 162-167
Space group: P -1
Cell volume: 1298.3
Cell parameters: 6.9369; 6.9624; 28.483; 89.524; 85.622; 71.202;  

COD ID: 2242019
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 N4 O3 S -
Comments: Bahoussi, Rawia Imane; Djafri, Ahmed; Chouaih, Abdelkader; Djafri, Ayada; Hamzaoui, Fodil Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymethyl)-4<i>H</i>-1,2,4-triazol-3-yl]sulfanyl}acetate Acta Crystallographica Section E 73(2) (2017) 173-176
Space group: P 1 21 1
Cell volume: 873.43
Cell parameters: 4.088; 21.2246; 10.2037; 90; 99.407; 90;  

COD ID: 2242020
CIF file

HKL data

Original IUCr paper

Formula: - Cl2 K5 Na O12 S4 -
Comments: Harrison, William T. A.; Plater, M. John An unexpected oxidation: NaK~5~Cl~2~(S~2~O~6~)~2~ revisited Acta Crystallographica Section E 73(2) (2017) 188-191
Space group: P 4/n
Cell volume: 1652.05
Cell parameters: 12.0421; 12.0421; 11.3925; 90; 90; 90;  

COD ID: 2242021
CIF file

HKL data

Original IUCr paper

Formula: - C H3 N2 O Rb -
Comments: Grassl, Tobias; Korber, Nikolaus Crystal structure of rubidium methyldiazotate Acta Crystallographica Section E 73(2) (2017) 159-161
Space group: P 1 21/n 1
Cell volume: 397.441
Cell parameters: 6.8658; 8.7614; 7.2447; 90; 114.219; 90;  

COD ID: 2242022
CIF file

HKL data

Original IUCr paper

Formula: - C14 H18 Cl4 Cu N4 O2 -
Comments: Mokaddem, Sonia; Boughzala, Habib Bis(imidazo[1,2-<i>a</i>]pyridin-1-ium) tetrachloridocuprate(II) dihydrate Acta Crystallographica Section E 73(2) (2017) 196-199
Space group: C 1 2/c 1
Cell volume: 1947.5
Cell parameters: 11.747; 9.793; 17.339; 90; 102.48; 90;  

COD ID: 2242023
CIF file

HKL data

Original IUCr paper

Formula: - C8 H8 O2 -
Comments: Baisch, Ulrich; Scicluna, Marie Christine; Näther, Christian; Vella-Zarb, Liana Planar <i>versus</i> non-planar: The important role of weak C—H···O hydrogen bonds in the crystal structure of 5-methylsalicylaldehyde Acta Crystallographica Section E 73(2) (2017) 155-158
Space group: P 1 21/c 1
Cell volume: 681.8
Cell parameters: 8.3676; 13.088; 6.4867; 90; 106.3; 90;  

COD ID: 2242025
CIF file

HKL data

Original IUCr paper

Formula: - H6 N2 O2 Rb2 -
Comments: Grassl, Tobias; Korber, Nikolaus Crystal structure of rubidium peroxide ammonia disolvate Acta Crystallographica Section E 73(2) (2017) 200-202
Space group: P n m a
Cell volume: 550.57
Cell parameters: 7.3957; 4.0932; 18.1873; 90; 90; 90;  

COD ID: 2242026
CIF file

HKL data

Original IUCr paper

Formula: - C20 H26 Fe N8 O2 -
Comments: Tanaka, Rikako; Matsushita, Nobuyuki Crystal structure of bis(1-ethylpyridinium) dioxonium hexacyanidoferrate(II) Acta Crystallographica Section E 73(2) (2017) 219-222
Space group: P n n m
Cell volume: 1209.79
Cell parameters: 11.8807; 12.1279; 8.3962; 90; 90; 90;  

COD ID: 2242027
CIF file

HKL data

Original IUCr paper

Formula: - C6 H10 As K N O4.5 -
Comments: Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E 73(2) (2017) 203-208
Space group: C m c 21
Cell volume: 1987.7
Cell parameters: 24.3426; 10.4266; 7.8315; 90; 90; 90;  

COD ID: 2242028
CIF file

HKL data

Original IUCr paper

Formula: - C6 H10 As N O4.5 Rb -
Comments: Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E 73(2) (2017) 203-208
Space group: C m c 21
Cell volume: 2072.9
Cell parameters: 24.4783; 10.4577; 8.0978; 90; 90; 90;  

COD ID: 2242029
CIF file

HKL data

Original IUCr paper

Formula: - C6 H10 As Cs N O4.5 -
Comments: Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E 73(2) (2017) 203-208
Space group: C m c 21
Cell volume: 2160.9
Cell parameters: 24.65; 10.4373; 8.3992; 90; 90; 90;  

COD ID: 2242030
CIF file

HKL data

Formula: - C22 H22 Cu N4 O6 -
Comments: Poyraz, Mehmet; Sarı, Musa Crystal structure of <i>catena</i>-poly[[bis(acetato-κ<i>O</i>)copper(II)]-bis[μ-4-(1<i>H</i>-imidazol-1-yl)phenol]-κ^2^<i>N</i>^3^:<i>O</i>;κ^2^<i>O</i>:<i>N</i>^3^] Acta Crystallographica Section E 73(2) (2017) 209-212
Space group: P 1 21/c 1
Cell volume: 1114.3
Cell parameters: 10.2029; 15.089; 7.7814; 90; 111.545; 90;  

COD ID: 2242031
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 Cu2 O10 -
Comments: van der Horn, Jitschaq A.; Lutz, Martin Crystal structure of <i>catena</i>-poly[[copper(II)-μ~2~-salicylato-[diaquacopper(II)]-μ~2~-salicylato] dihydrate] Acta Crystallographica Section E 73(2) (2017) 235-238
Space group: P b c n
Cell volume: 1553.6
Cell parameters: 19.5028; 5.0553; 15.7573; 90; 90; 90;  

COD ID: 2242032
CIF file

HKL data

Original IUCr paper

Formula: - C14 H13 N3 O5 -
Comments: Kirandeep; Husain, Ahmad; Negi, Pooja; Kumar, Girijesh; Kataria, Ramesh Crystal structure of (<i>E</i>)-4-hydroxy-6-methyl-3-{1-[2-(4-nitrophenyl)hydrazinylidene]ethyl}-2<i>H</i>-pyran-2-one Acta Crystallographica Section E 73(2) (2017) 223-226
Space group: P 1 21/n 1
Cell volume: 1379.78
Cell parameters: 6.9633; 19.5008; 10.2031; 90; 95.196; 90;  

COD ID: 2242033
CIF file

Original IUCr paper

Formula: - C8 H18 Co O6 -
Comments: Fischer, Andrei I.; Gurzhiy, Vladislav V.; Aleksandrova, Julia V.; Pakina, Maria I. Crystal structure of a Co^II^ coordination polymer: <i>catena</i>-poly[[μ-aqua-bis(μ-2-methylpropanoato)-κ^2^<i>O</i>:<i>O</i>';κ^2^<i>O</i>:<i>O</i>-cobalt(II)] monohydrate] Acta Crystallographica Section E 73(3) (2017) 318-321
Space group: P 1 21/c 1
Cell volume: 1164.59
Cell parameters: 11.9999; 6.3815; 16.1374; 90; 109.54; 90;  

COD ID: 2242034
CIF file

HKL data

Original IUCr paper

Formula: - C52 H32 Cd2 N12 O16 -
Comments: Hökelek, Tuncer; Akduran, Nurcan; Özen, Azer; Uğurlu, Güventürk; Necefoğlu, Hacali Crystal structure of bis(μ-3-nitrobenzoato)-κ^3^<i>O</i>,<i>O</i>':<i>O</i>;κ^3^<i>O</i>:<i>O</i>,<i>O</i>'-bis[bis(3-cyanopyridine-κ<i>N</i>^1^)(3-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium] Acta Crystallographica Section E 73(3) (2017) 413-416
Space group: P -1
Cell volume: 1292.12
Cell parameters: 8.5237; 12.7145; 13.0583; 105.022; 97.347; 104.866;  

COD ID: 2242035
CIF file

HKL data

Original IUCr paper

Formula: - C32 H32 Cd2 N4 S8 -
Comments: Suwardi, Siti Aisyah Nabilah; Lee, See Mun; Lo, Kong Mun; Jotani, Mukesh M.; Tiekink, Edward R. T. Bis(μ~2~-<i>N</i>-methyl-<i>N</i>-phenyldithiocarbamato)-κ^3^<i>S</i>,<i>S</i>':<i>S</i>;κ^3^<i>S</i>:<i>S</i>,<i>S</i>'-bis[(<i>N</i>-methyl-<i>N</i>-phenyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')cadmium]: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(3) (2017) 429-433
Space group: P 1 21/c 1
Cell volume: 1843.11
Cell parameters: 12.7972; 6.4445; 22.582; 90; 98.247; 90;  

COD ID: 2242036
CIF file

HKL data

Original IUCr paper

Formula: - C12 H11 N O5 -
Comments: Kanazawa, Hitoshi; Inada, Aya Crystal structure of β-benzyl <small>DL</small>-aspartate <i>N</i>-carboxyanhydride Acta Crystallographica Section E 73(3) (2017) 445-447
Space group: P b c a
Cell volume: 2492
Cell parameters: 8.6065; 12.1558; 23.82; 90; 90; 90;  

COD ID: 2242037
CIF file

HKL data

Original IUCr paper

Formula: - C17 H14 N2 O5 -
Comments: Lien, Vegard Torp; Olberg, Dag Erlend; Klaveness, Jo; Görbitz, Carl Henrik Crystal structure of 6,7-dimethoxy-1-(4-nitrophenyl)quinolin-4(1<i>H</i>)-one: a molecular scaffold for potential tubulin polymerization inhibitors Acta Crystallographica Section E 73(3) (2017) 441-444
Space group: P 1 21/n 1
Cell volume: 1531.23
Cell parameters: 8.3736; 11.7694; 15.5623; 90; 93.251; 90;  

COD ID: 2242038
CIF file

HKL data

Original IUCr paper

Formula: - C38 H48 N2 O4 Ru -
Comments: Faizi, Md. Serajul Haque; Ali, Akram; Potaskalov, Vadim A. Crystal structure of (2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(3,5-di-<i>tert</i>-butyl-<i>o</i>-benzoquinonato-κ^2^<i>O</i>,<i>O</i>')ruthenium(II) Acta Crystallographica Section E 73(3) (2017) 459-462
Space group: P -1
Cell volume: 1756.9
Cell parameters: 10.125; 10.325; 17.419; 76.583; 83.238; 85.777;  

COD ID: 2242039
CIF file

HKL data

Original IUCr paper

Formula: - C17 H17 N O4 -
Comments: Kasyanova, Katerina V.; Kokozay, Vladimir N.; Buvaylo, Elena A.; Vassilyeva, Olga Yu.; Skelton, Brian W. Crystal structure of 4,10-dimethoxy-13-methyl-6<i>H</i>,12<i>H</i>-6,12-epiminodibenzo[<i>b</i>,<i>f</i>][1,5]dioxocine Acta Crystallographica Section E 73(3) (2017) 410-412
Space group: P -1
Cell volume: 695.46
Cell parameters: 6.9956; 8.8589; 12.0938; 93.98; 106.603; 102.133;  

COD ID: 2242040
CIF file

HKL data

Formula: - C14 H13 Br O4 -
Comments: Bauri, A. K.; Foro, Sabine; Rahman, A. F. M. Mustafizur Crystal structure of a photobiologically active brominated angular pyranocoumarin: bromo-hydroxy-seselin Acta Crystallographica Section E 73(3) (2017) 453-455
Space group: P 1 21/n 1
Cell volume: 1338
Cell parameters: 6.9573; 23.465; 8.3435; 90; 100.79; 90;  

COD ID: 2242041
CIF file

HKL data

Original IUCr paper

Formula: - C34 H42 Br1.52 Cl0.48 Hg N4 -
Comments: Rani, Varsha; Singh, Harkesh B.; Butcher, Ray J. Structure of the mercury(II) mixed-halide (Br/Cl) complex of 2,2'-(5-<i>tert</i>-butyl-1,3-phenylene)bis(1-pentyl-1<i>H</i>-benzo[<i>d</i>]imidazole) Acta Crystallographica Section E 73(3) (2017) 423-428
Space group: P c a 21
Cell volume: 6717.4
Cell parameters: 22.8887; 13.883; 21.1396; 90; 90; 90;  

COD ID: 2242042
CIF file

HKL data

Formula: - C12 H20 Ag N3 O3 S4 -
Comments: Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate complexes of three tetrakis-thioether-substituted pyrazine ligands: metal‒organic chain, network and framework structures Acta Crystallographica Section E 73(3) (2017) 434-440
Space group: P 1 21/n 1
Cell volume: 1800.9
Cell parameters: 10.167; 13.482; 13.377; 90; 100.838; 90;  

COD ID: 2242043
CIF file

HKL data

Formula: - C32 H28 Ag2 N4 O6 S4 -
Comments: Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate complexes of three tetrakis-thioether-substituted pyrazine ligands: metal‒organic chain, network and framework structures Acta Crystallographica Section E 73(3) (2017) 434-440
Space group: P 1 21/c 1
Cell volume: 1712.7
Cell parameters: 11.8437; 18.5674; 7.8444; 90; 96.856; 90;  

COD ID: 2242044
CIF file

HKL data

Formula: - C28 H24 Ag3 N9 O9 S4 -
Comments: Assoumatine, Tokouré; Stoeckli-Evans, Helen Silver(I) nitrate complexes of three tetrakis-thioether-substituted pyrazine ligands: metal‒organic chain, network and framework structures Acta Crystallographica Section E 73(3) (2017) 434-440
Space group: C 1 2/c 1
Cell volume: 3453
Cell parameters: 13.6319; 16.2211; 15.7201; 90; 96.607; 90;  

COD ID: 2242045
CIF file

HKL data

Original IUCr paper

Formula: - B2 Ga Li3 O6 -
Comments: Smith, Robert W.; Holman, Darien; Villa, Eric M. Crystal structure of Li~3~Ga(BO~3~)~2~ Acta Crystallographica Section E 73(3) (2017) 456-458
Space group: P -1
Cell volume: 233.54
Cell parameters: 4.8731; 6.2429; 8.013; 73.346; 89.701; 89.698;  

COD ID: 2242046
CIF file

HKL data

Original IUCr paper

Formula: - C24 H38 Si2 -
Comments: Pichaandi, Kothanda Rama; Mague, Joel T.; Fink, Mark J. Crystal structures of three sterically congested disilanes Acta Crystallographica Section E 73(3) (2017) 448-452
Space group: P 1 21/n 1
Cell volume: 4617.3
Cell parameters: 19.8418; 8.2554; 28.454; 90; 97.838; 90;  

COD ID: 2242047
CIF file

HKL data

Original IUCr paper

Formula: - C24 H34 Br4 Si2 -
Comments: Pichaandi, Kothanda Rama; Mague, Joel T.; Fink, Mark J. Crystal structures of three sterically congested disilanes Acta Crystallographica Section E 73(3) (2017) 448-452
Space group: P 1 21/c 1
Cell volume: 2742.8
Cell parameters: 8.8779; 10.4042; 29.699; 90; 90.975; 90;  

COD ID: 2242048
CIF file

HKL data

Original IUCr paper

Formula: - C32 H38 Si2 -
Comments: Pichaandi, Kothanda Rama; Mague, Joel T.; Fink, Mark J. Crystal structures of three sterically congested disilanes Acta Crystallographica Section E 73(3) (2017) 448-452
Space group: P 1 21/c 1
Cell volume: 1345.37
Cell parameters: 8.5622; 10.2107; 15.4586; 90; 95.452; 90;  

COD ID: 2242049
CIF file

HKL data

Original IUCr paper

Formula: - C49 H59.5 Cl2 F2 N10.5 O10 -
Comments: Zeller, Matthias; de Araujo, Gabriel Lima Barros; Parker, Trev; Singh Rai, Amrinder; Byrn, Stephen R. A new solvate of afatinib, a specific inhibitor of the ErbB family of tyrosine kinases Acta Crystallographica Section E 73(3) (2017) 417-422
Space group: P 4 21 2
Cell volume: 10443.1
Cell parameters: 26.2427; 26.2427; 15.1639; 90; 90; 90;  

COD ID: 2242050
CIF file

HKL data

Original IUCr paper

Formula: - As3 Fe2 K1.25 Ni0.88 O12 -
Comments: Ben Smail, Ridha; Zid, Mohamed Faouzi K~1+2<i>x~</i>Ni~1{-~<i>x</i>}Fe~2~(AsO~4~)~3~ (<i>x</i> = 0,125): un nouvel arséniate à structure de type α-CrPO~4~ Acta Crystallographica Section E 73(2) (2017) 239-245
Space group: I b m m
Cell volume: 985.2
Cell parameters: 6.737; 10.773; 13.574; 90; 90; 90;  

COD ID: 2242051
CIF file

HKL data

Original IUCr paper

Formula: - C18 H38 N2 O2 S4 Sn -
Comments: Mohamad, Rapidah; Awang, Normah; Kamaludin, Nurul F.; Jotani, Mukesh M.; Tiekink, Edward R. T. Di-<i>n</i>-butylbis[<i>N</i>-(2-methoxyethyl)-<i>N</i>-methyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>']tin(IV): crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(2) (2017) 260-265
Space group: P 1 21/m 1
Cell volume: 1321.74
Cell parameters: 7.1021; 18.0761; 10.8809; 90; 108.877; 90;  

COD ID: 2242052
CIF file

HKL data

Original IUCr paper

Formula: - C16 H15 N5 O S -
Comments: Subasri, S.; Kumar, Timiri Ajay; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Viswanathan, Vijayan; Velmurugan, Devadasan Crystal structures of 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(naphthalen-1-yl)acetamide and 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(4-fluorophenyl)acetamide Acta Crystallographica Section E 73(2) (2017) 306-309
Space group: P 1 21/c 1
Cell volume: 1568.08
Cell parameters: 25.1895; 6.9411; 8.9697; 90; 90.943; 90;  

COD ID: 2242053
CIF file

HKL data

Original IUCr paper

Formula: - C12 H12 F N5 O S -
Comments: Subasri, S.; Kumar, Timiri Ajay; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Viswanathan, Vijayan; Velmurugan, Devadasan Crystal structures of 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(naphthalen-1-yl)acetamide and 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(4-fluorophenyl)acetamide Acta Crystallographica Section E 73(2) (2017) 306-309
Space group: P 1 21/c 1
Cell volume: 1351.93
Cell parameters: 21.7358; 7.3726; 8.4487; 90; 93.092; 90;  

COD ID: 2242054
CIF file

HKL data

Original IUCr paper

Formula: - C16 H24 Cl Ir -
Comments: Rahman, A. K. Fazlur; Wilklow-Marnell, Miles; Brennessel, William W.; Jones, William D. Crystal structure of chloridobis[(1,2,5,6-η)-cycloocta-1,5-diene]iridium(I) Acta Crystallographica Section E 73(2) (2017) 273-277
Space group: P b c a
Cell volume: 2738.1
Cell parameters: 12.8756; 13.3719; 15.9033; 90; 90; 90;  

COD ID: 2242055
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 Cl4 Cu2 N4 O8 -
Comments: Inah, Bassey Enyi; Ayi, Ayi Anyama; Adhikary, Amit Crystal structure of a chloride-bridged copper(II) dimer: piperazine-1,4-dium bis(di-μ-chlorido-bis[(4-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)chloridocuprate(II)] Acta Crystallographica Section E 73(2) (2017) 246-249
Space group: P 1 21/c 1
Cell volume: 1183.4
Cell parameters: 11.639; 9.224; 11.423; 90; 105.211; 90;  

COD ID: 2242056
CIF file

HKL data

Original IUCr paper

Formula: - C22 H25 N3 O7 S -
Comments: N'ait Ousidi, Abdellah; Ait Itto, My Youssef; Auhmani, Aziz; Riahi, Abdelkhalek; Auhmani, Abdelwahed; Daran, Jean-Claude Crystal structure of dimethyl 2-((2<i>Z</i>,5<i>Z</i>)-5-(2-methoxy-2-oxoethylidene)-2-{(<i>E</i>)-[2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enylidene]hydrazinylidene}-4-oxothiazolidin-3-yl)fumarate Acta Crystallographica Section E 73(2) (2017) 296-299
Space group: P -1
Cell volume: 1170.14
Cell parameters: 8.2468; 9.8783; 15.1039; 96.144; 105.172; 95.75;  

COD ID: 2242057
CIF file

HKL data

Formula: - C32 H28 N10 O4 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen Crystal structures of <i>N</i>^2^,<i>N</i>^3^,<i>N</i>^5^,<i>N</i>^6^-tetrakis(pyridin-2-ylmethyl)pyrazine-2,3,5,6-tetracarboxamide and <i>N</i>^2^,<i>N</i>^3^,<i>N</i>^5^,<i>N</i>^6^-tetrakis(pyridin-4-ylmethyl)pyrazine-2,3,5,6-tetracarboxamide Acta Crystallographica Section E 73(2) (2017) 300-305
Space group: P 1 21/n 1
Cell volume: 3182.6
Cell parameters: 16.0754; 11.8602; 18.495; 90; 115.503; 90;  

COD ID: 2242058
CIF file

HKL data

Formula: - C32 H28 N10 O4 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen Crystal structures of <i>N</i>^2^,<i>N</i>^3^,<i>N</i>^5^,<i>N</i>^6^-tetrakis(pyridin-2-ylmethyl)pyrazine-2,3,5,6-tetracarboxamide and <i>N</i>^2^,<i>N</i>^3^,<i>N</i>^5^,<i>N</i>^6^-tetrakis(pyridin-4-ylmethyl)pyrazine-2,3,5,6-tetracarboxamide Acta Crystallographica Section E 73(2) (2017) 300-305
Space group: P 1 21/n 1
Cell volume: 1519.37
Cell parameters: 9.8592; 10.6511; 14.8089; 90; 102.306; 90;  

COD ID: 2242059
CIF file

HKL data

Original IUCr paper

Formula: - C7 H8 N2 O4 -
Comments: Kennedy, Alan R.; Khalaf, Abedawn I.; Scott, Fraser J.; Suckling, Colin J. Four pyrrole derivatives used as building blocks in the synthesis of minor-groove binders Acta Crystallographica Section E 73(2) (2017) 254-259
Space group: P 1 21/c 1
Cell volume: 817.32
Cell parameters: 11.0318; 10.4108; 7.1659; 90; 96.734; 90;  

COD ID: 2242060
CIF file

HKL data

Original IUCr paper

Formula: - C12 H14 N2 O4 -
Comments: Kennedy, Alan R.; Khalaf, Abedawn I.; Scott, Fraser J.; Suckling, Colin J. Four pyrrole derivatives used as building blocks in the synthesis of minor-groove binders Acta Crystallographica Section E 73(2) (2017) 254-259
Space group: P 1 21/c 1
Cell volume: 1257.78
Cell parameters: 7.8839; 16.1443; 10.2058; 90; 104.472; 90;  

COD ID: 2242061
CIF file

HKL data

Original IUCr paper

Formula: - C15 H26 N4 O3 -
Comments: Kennedy, Alan R.; Khalaf, Abedawn I.; Scott, Fraser J.; Suckling, Colin J. Four pyrrole derivatives used as building blocks in the synthesis of minor-groove binders Acta Crystallographica Section E 73(2) (2017) 254-259
Space group: P 1 21/c 1
Cell volume: 1743.55
Cell parameters: 17.5744; 11.3718; 8.7299; 90; 92.076; 90;  

COD ID: 2242062
CIF file

HKL data

Original IUCr paper

Formula: - C20 H27 N9 O5 -
Comments: Kennedy, Alan R.; Khalaf, Abedawn I.; Scott, Fraser J.; Suckling, Colin J. Four pyrrole derivatives used as building blocks in the synthesis of minor-groove binders Acta Crystallographica Section E 73(2) (2017) 254-259
Space group: P 1 21/c 1
Cell volume: 2226.32
Cell parameters: 11.2809; 16.4528; 12.513; 90; 106.542; 90;  

COD ID: 2242063
CIF file

HKL data

Original IUCr paper

Formula: - C29 H24 Cl10 Cu6 N18 O2 -
Comments: Shi, Kaige; Mathivathanan, Logesh; Raptis, Raphael G. Crystal structure of μ~6~-chlorido-nonakis(μ-4-chloropyrazolato)bis-μ~3~-methoxo-hexacopper(II) Acta Crystallographica Section E 73(2) (2017) 266-269
Space group: P b c n
Cell volume: 4469.8
Cell parameters: 16.565; 18.474; 14.606; 90; 90; 90;  

COD ID: 2242064
CIF file

HKL data

Original IUCr paper

Formula: - C32 H16 N2 O8 Re2 S2 -
Comments: Priyatharsini, Maruthupandiyan; Shankar, Bhaskaran; Sathiyendiran, Malaichamy; Srinivasan, Navaneethakrishnan; Krishnakumar, Rajaputi Venkatraman Crystal structure of the <i>cis</i> and <i>trans</i> polymorphs of bis[μ-2-(1,3-benzothiazol-2-yl)phenolato]-κ^3^<i>N</i>,<i>O</i>:<i>O</i>;κ^3^<i>O</i>:<i>N</i>,<i>O</i>-bis[<i>fac</i>-tricarbonylrhenium(I)] Acta Crystallographica Section E 73(2) (2017) 310-313
Space group: P -1
Cell volume: 716.58
Cell parameters: 8.925; 9.7342; 10.0844; 66.438; 75.636; 63.585;  

COD ID: 2242065
CIF file

HKL data

Formula: - C32 H16 N2 O8 Re2 S2 -
Comments: Priyatharsini, Maruthupandiyan; Shankar, Bhaskaran; Sathiyendiran, Malaichamy; Srinivasan, Navaneethakrishnan; Krishnakumar, Rajaputi Venkatraman Crystal structure of the <i>cis</i> and <i>trans</i> polymorphs of bis[μ-2-(1,3-benzothiazol-2-yl)phenolato]-κ^3^<i>N</i>,<i>O</i>:<i>O</i>;κ^3^<i>O</i>:<i>N</i>,<i>O</i>-bis[<i>fac</i>-tricarbonylrhenium(I)] Acta Crystallographica Section E 73(2) (2017) 310-313
Space group: P b c n
Cell volume: 2941.4
Cell parameters: 16.148; 11.6519; 15.6329; 90; 90; 90;  

COD ID: 2242066
CIF file

HKL data

Original IUCr paper

Formula: - C14 H33 N3 O16 Tb -
Comments: Gregório, Thaiane; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L. Crystal structures of two mononuclear complexes of terbium(III) nitrate with the tripodal alcohol 1,1,1-tris(hydroxymethyl)propane Acta Crystallographica Section E 73(2) (2017) 278-285
Space group: I 1 2/a 1
Cell volume: 4712.4
Cell parameters: 20.1864; 10.2997; 23.832; 90; 108.004; 90;  

COD ID: 2242067
CIF file

HKL data

Original IUCr paper

Formula: - C12 H30 N3 O16 Tb -
Comments: Gregório, Thaiane; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L. Crystal structures of two mononuclear complexes of terbium(III) nitrate with the tripodal alcohol 1,1,1-tris(hydroxymethyl)propane Acta Crystallographica Section E 73(2) (2017) 278-285
Space group: P 1 21/c 1
Cell volume: 2256.5
Cell parameters: 9.144; 12.787; 19.7151; 90; 101.796; 90;  

COD ID: 2242068
CIF file

HKL data

Original IUCr paper

Formula: - C8 H12 Ag2 Fe N4 O2 S2 -
Comments: Kucheriv, Olesia I.; Naumova, Dina D.; Tokmenko, Inna I.; Polunin, Ruslan A.; Terebilenko, Kateryna V. Crystal structure of poly[tetra-μ~2~-cyanido-1:2κ^8^<i>N</i>:<i>C</i>-bis(dimethyl sulfoxide-1κ<i>O</i>)diargentate(I)iron(II)] Acta Crystallographica Section E 73(2) (2017) 270-272
Space group: P 1 21/c 1
Cell volume: 817.9
Cell parameters: 8.4125; 14.492; 7.4679; 90; 116.053; 90;  

COD ID: 2242069
CIF file

HKL data

Original IUCr paper

Formula: - C8 H9 N2 O3 Re S2 -
Comments: Tan, Sang Loon; Lee, See Mun; Heard, Peter J.; Halcovitch, Nathan R.; Tiekink, Edward R. T. <i>fac</i>-Acetonitriletricarbonyl(dimethylcarbamodithioato-κ^2^<i>S</i>,<i>S</i>')rhenium(I): crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(2) (2017) 213-218
Space group: P -1
Cell volume: 613.708
Cell parameters: 5.7442; 7.5022; 14.6644; 91.496; 95.517; 102.371;  

COD ID: 2242070
CIF file

HKL data

Formula: - C13 H17 N3 S -
Comments: de Oliveira, Adriano Bof; Beck, Johannes; Landvogt, Christian; de Farias, Renan Lira; Feitoza, Bárbara Regina Santos Crystal structure of <i>N</i>-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylidene)hydrazinecarbothioamide Acta Crystallographica Section E 73(2) (2017) 291-295
Space group: P 1 21/c 1
Cell volume: 2600.52
Cell parameters: 11.1342; 10.233; 23.399; 90; 102.724; 90;  

COD ID: 2242071
CIF file

HKL data

Original IUCr paper

Formula: - C15 H15 N O S -
Comments: de Oliveira, Gabriela Porto; Bresolin, Leandro; Flores, Darlene Correia; de Farias, Renan Lira; de Oliveira, Adriano Bof Crystal structure of (2<i>E</i>)-3-[4-(dimethylamino)phenyl]-1-(thiophen-2-yl)prop-2-en-1-one Acta Crystallographica Section E 73(4) (2017) 476-480
Space group: P 1 21/n 1
Cell volume: 1294.65
Cell parameters: 6.2405; 9.9975; 20.7815; 90; 93.097; 90;  

COD ID: 2242072
CIF file

HKL data

Original IUCr paper

Formula: - C12 H12 Cl N5 O S -
Comments: Subasri, S.; Kumar, Timiri Ajay; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Viswanathan, Vijayan; Velmurugan, Devadasan Crystal structures of <i>N</i>-(4-chlorophenyl)-2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]acetamide and <i>N</i>-(3-chlorophenyl)-2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]acetamide Acta Crystallographica Section E 73(4) (2017) 467-471
Space group: P b c a
Cell volume: 2708.1
Cell parameters: 18.2743; 7.4835; 19.8021; 90; 90; 90;  

COD ID: 2242073
CIF file

HKL data

Original IUCr paper

Formula: - C12 H12 Cl N5 O S -
Comments: Subasri, S.; Kumar, Timiri Ajay; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Viswanathan, Vijayan; Velmurugan, Devadasan Crystal structures of <i>N</i>-(4-chlorophenyl)-2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]acetamide and <i>N</i>-(3-chlorophenyl)-2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]acetamide Acta Crystallographica Section E 73(4) (2017) 467-471
Space group: P 1 21/c 1
Cell volume: 2748.9
Cell parameters: 18.22; 8.118; 19.628; 90; 108.761; 90;  

COD ID: 2242074
CIF file

HKL data

Original IUCr paper

Formula: - C18 H33 P S -
Comments: Tan, Yi Jiun; Yeo, Chien Ing; Halcovitch, Nathan R.; Jotani, Mukesh M.; Tiekink, Edward R. T. A triclinic polymorph of tricyclohexylphosphane sulfide: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(4) (2017) 493-499
Space group: P -1
Cell volume: 887.26
Cell parameters: 6.64; 10.8089; 12.8818; 103.43; 98.467; 91.912;  

COD ID: 2242075
CIF file

HKL data

Original IUCr paper

Formula: - C19 H23 N O5 -
Comments: Kvyatkovskaya, Elisaveta A.; Zaytsev, Vladimir P.; Zubkov, Fedor I.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N. Interaction between maleic acid and <i>N</i>-<i>R</i>-furfurylamines: crystal structure of 2-methyl-<i>N</i>-[(5-phenylfuran-2-yl)methyl]propan-2-aminium (2<i>Z</i>)-3-carboxyacrylate and <i>N</i>-[(5-iodofuran-2-yl)methyl]-2-methylpropan-2-aminium (2<i>Z</i>)-3-carboxyprop-2-enoate Acta Crystallographica Section E 73(4) (2017) 515-519
Space group: P -1
Cell volume: 895.57
Cell parameters: 7.5177; 9.8339; 12.1951; 94.387; 94.552; 91.578;  

COD ID: 2242076
CIF file

HKL data

Original IUCr paper

Formula: - C13 H18 I N O5 -
Comments: Kvyatkovskaya, Elisaveta A.; Zaytsev, Vladimir P.; Zubkov, Fedor I.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N. Interaction between maleic acid and <i>N</i>-<i>R</i>-furfurylamines: crystal structure of 2-methyl-<i>N</i>-[(5-phenylfuran-2-yl)methyl]propan-2-aminium (2<i>Z</i>)-3-carboxyacrylate and <i>N</i>-[(5-iodofuran-2-yl)methyl]-2-methylpropan-2-aminium (2<i>Z</i>)-3-carboxyprop-2-enoate Acta Crystallographica Section E 73(4) (2017) 515-519
Space group: P 1 21/n 1
Cell volume: 1564.8
Cell parameters: 5.7501; 28.272; 9.6402; 90; 93.17; 90;  

COD ID: 2242077
CIF file

HKL data

Original IUCr paper

Formula: - C18 H10 Cl2 N2 O2 -
Comments: Ivashevskaya, Svetlana N. Crystal structure of Pigment Red 254 from X-ray powder diffraction data Acta Crystallographica Section E 73(4) (2017) 507-510
Space group: P -1
Cell volume: 380.42
Cell parameters: 3.871; 6.553; 15.292; 92.773; 94.656; 99.627;  

COD ID: 2242078
CIF file

HKL data

Original IUCr paper

Formula: - C6 H7 Cs3 O8 -
Comments: Rammohan, Alagappa; Sarjeant, Amy A.; Kaduk, James A. Tricaesium citrate monohydrate, Cs~3~C~6~H~5~O~7~·H~2~O: crystal structure and DFT comparison Acta Crystallographica Section E 73(4) (2017) 520-523
Space group: P 1 21/n 1
Cell volume: 1277.69
Cell parameters: 7.7529; 12.0281; 13.8043; 90; 97; 90;  

COD ID: 2242079
CIF file

Original IUCr paper

Formula: - C6 H7 Cs3 O8 -
Comments: Rammohan, Alagappa; Sarjeant, Amy A.; Kaduk, James A. Tricaesium citrate monohydrate, Cs~3~C~6~H~5~O~7~·H~2~O: crystal structure and DFT comparison Acta Crystallographica Section E 73(4) (2017) 520-523
Space group: P 1 21/n 1
Cell volume: 1277.69
Cell parameters: 7.7529; 12.0281; 13.8043; 90; 97; 90;  

COD ID: 2242080
CIF file

HKL data

Original IUCr paper

Formula: - C22 H25 N O5 -
Comments: Manchado, Alejandro; Salgado, Mateo M.; Vicente, Álvaro; Díez, David; Sanz, Francisca; Garrido, Narciso M. Crystal structure of methyl (4<i>R</i>)-4-(4-methoxybenzoyl)-4-{[(1<i>R</i>)-1-phenylethyl]carbamoyl}butanoate Acta Crystallographica Section E 73(4) (2017) 503-506
Space group: P 21 21 21
Cell volume: 2050.3
Cell parameters: 23.739; 4.7791; 18.0722; 90; 90; 90;  

COD ID: 2242081
CIF file

HKL data

Original IUCr paper

Formula: - C24 H19 N3 O5 S -
Comments: Djafri, Ahmed; Chouaih, Abdelkader; Daran, Jean-Claude; Djafri, Ayada; Hamzaoui, Fodil Crystal and molecular structure of (2<i>Z</i>,5<i>Z</i>)-3-(2-methoxyphenyl)-2-[(2-methoxyphenyl)imino]-5-(4-nitrobenzylidene)thiazolidin-4-one Acta Crystallographica Section E 73(4) (2017) 511-514
Space group: P 1 21/c 1
Cell volume: 2179.21
Cell parameters: 15.6096; 8.8817; 15.8973; 90; 98.601; 90;  

COD ID: 2242082
CIF file

HKL data

Original IUCr paper

Formula: - C16 H32 Cl2 N4 O4 Pd -
Comments: Lasri, Jamal; Eltayeb, Naser Eltaher; Haukka, Matti; Babgi, Bandar A. Crystal structure of <i>trans</i>-dichloridobis[<i>N</i>-(5,5-dimethyl-4,5-dihydro-3<i>H</i>-pyrrol-2-yl-κ<i>N</i>)acetamide]palladium(II) dihydrate Acta Crystallographica Section E 73(4) (2017) 528-530
Space group: P 1 21/c 1
Cell volume: 2314
Cell parameters: 15.945; 8.765; 16.894; 90; 101.481; 90;  

COD ID: 2242083
CIF file

HKL data

Original IUCr paper

Formula: - C16 H10 Cl2 N2 O2 S -
Comments: Kumar, Rajesh; Hussain, Shafqat; Khan, Khalid M.; Perveen, Shahnaz; Yousuf, Sammer Crystal structure and Hirshfeld surface analysis of 1-(4-chlorophenyl)-2-{[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone Acta Crystallographica Section E 73(4) (2017) 524-527
Space group: P 1 21/c 1
Cell volume: 1603.26
Cell parameters: 19.1513; 11.1589; 7.5071; 90; 92.088; 90;  

COD ID: 2242084
CIF file

HKL data

Formula: - C12 H11 N O3 -
Comments: Shaik, Althaf; Kirubakaran, Sivapriya; Thiruvenkatam, Vijay Crystal structure and Hirshfeld surface analysis of ethyl 5-phenylisoxazole-3-carboxylate Acta Crystallographica Section E 73(4) (2017) 531-534
Space group: P 1 21/n 1
Cell volume: 1096.7
Cell parameters: 5.4447; 17.18; 11.7603; 90; 94.508; 90;  

COD ID: 2242085
CIF file

Original IUCr paper

Formula: - C20 H10 Cl5 N3 O5 Ru2 -
Comments: Tatikonda, Rajendhraprasad; Haukka, Matti Ruthenium(II) carbonyl compounds with the 4'-chloro-2,2':6',2''-terpyridine ligand Acta Crystallographica Section E 73(4) (2017) 556-559
Space group: P 1 21/c 1
Cell volume: 2411.86
Cell parameters: 14.3578; 13.9158; 13.222; 90; 114.08; 90;  

COD ID: 2242086
CIF file

Original IUCr paper

Formula: - C17 H10 Cl3 N3 O2 Ru -
Comments: Tatikonda, Rajendhraprasad; Haukka, Matti Ruthenium(II) carbonyl compounds with the 4'-chloro-2,2':6',2''-terpyridine ligand Acta Crystallographica Section E 73(4) (2017) 556-559
Space group: P -1
Cell volume: 889.08
Cell parameters: 7.3019; 8.508; 14.7702; 101.287; 91.835; 98.144;  

COD ID: 2242087
CIF file

HKL data

Original IUCr paper

Formula: - C14 H8 Br2 -
Comments: Kim, Nicholas S.; Thamattoor, Dasan M. Crystal structure of 4,5-dibromophenanthrene Acta Crystallographica Section E 73(4) (2017) 539-542
Space group: C 1 2/c 1
Cell volume: 1146.9
Cell parameters: 16.84; 8.6112; 8.1418; 90; 103.735; 90;  

COD ID: 2242088
CIF file

HKL data

Formula: - C17 H15 N O4 -
Comments: Inada, Aya; Kanazawa, Hitoshi Crystal structure of (<i>S</i>)-4-[4-(benzyloxy)benzyl]oxazolidine-2,5-dione Acta Crystallographica Section E 73(4) (2017) 553-555
Space group: P 1 21 1
Cell volume: 717.43
Cell parameters: 7.7388; 5.9128; 15.7769; 90; 96.39; 90;  

COD ID: 2242089
CIF file

HKL data

Formula: - C12 H9 N3 O4 -
Comments: Faizi, Md. Serajul Haque; Haque, Ashanul; Dege, Necmi; Hasan, Syed Imran; Dege, Mustafa; Kalibabchuk, Valentina A. Crystal structure of 4,4'-dinitro-[1,1'-biphenyl]-2-amine Acta Crystallographica Section E 73(4) (2017) 550-552
Space group: P 1 21/c 1
Cell volume: 1151.15
Cell parameters: 14.294; 7.0352; 11.6043; 90; 99.437; 90;  

COD ID: 2242090
CIF file

HKL data

Original IUCr paper

Formula: - C18 H18 N2 S2 -
Comments: Yusof, Enis Nadia Md; Tahir, Mohamed I. M.; Ravoof, Thahira B. S. A.; Tan, Sang Loon; Tiekink, Edward R. T. A cinnamaldehyde Schiff base of <i>S</i>-(4-methylbenzyl) dithiocarbazate: crystal structure, Hirshfeld surface analysis and computational study Acta Crystallographica Section E 73(4) (2017) 543-549
Space group: P -1
Cell volume: 851
Cell parameters: 5.672; 12.6288; 13.469; 62.451; 84.441; 88.93;  

COD ID: 2242091
CIF file

HKL data

Formula: - C11 H10 Ag N5 O4 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen The silver(I) nitrate complex of the ligand <i>N</i>-(pyridin-2-ylmethyl)pyrazine-2-carboxamide: a metal‒organic framework (MOF) structure Acta Crystallographica Section E 73(4) (2017) 535-538
Space group: P c a 21
Cell volume: 1410.1
Cell parameters: 17.522; 8.9559; 8.986; 90; 90; 90;  

COD ID: 2242092
CIF file

HKL data

Original IUCr paper

Formula: - C12 H17 Cl O Te -
Comments: Zukerman-Schpector, Julio; Cunha, Rodrigo; Omori, Álvaro T.; Sousa Madureira, Lucas; Tiekink, Edward R. T. 1-Butyl-1-chloro-3-methyl-3<i>H</i>-2,1λ^4^-benzoxatellurole: crystal structure and Hirshfeld analysis Acta Crystallographica Section E 73(4) (2017) 564-568
Space group: P 1 21 1
Cell volume: 1330.53
Cell parameters: 8.3663; 13.0442; 12.5363; 90; 103.46; 90;  

COD ID: 2242093
CIF file

HKL data

Original IUCr paper

Formula: - C14 H12 N2 O8 -
Comments: Salamzadeh, Nina; Demircioglu, Zeynep; Korkmaz, Ufuk; Büyükgüngör, Orhan Crystal structure of 2-(azaniumylmethyl)pyridinium bis(hydrogen squarate) Acta Crystallographica Section E 73(4) (2017) 586-589
Space group: P 1 21/n 1
Cell volume: 1408.7
Cell parameters: 7.4653; 15.4548; 12.2095; 90; 90.073; 90;  

COD ID: 2242094
CIF file

HKL data

Formula: - C13 H13 N3 O2 S -
Comments: Saranya, Sivaraj; Haribabu, Jebiti; Bhuvanesh, Nattamai S. P.; Karvembu, Ramasamy; Gayathri, Dasararaju Crystal structures of the Schiff base derivatives (<i>E</i>)-<i>N</i>'-[(1<i>H</i>-indol-3-yl)methylidene]isonicotinohydrazide ethanol monosolvate and (<i>E</i>)-<i>N</i>-methyl-2-[1-(2-oxo-2<i>H</i>-chromen-3-yl)ethylidene]hydrazinecarbothioamide Acta Crystallographica Section E 73(4) (2017) 594-597
Space group: P 1 21/c 1
Cell volume: 1292.7
Cell parameters: 9.289; 9.616; 14.474; 90; 90.825; 90;  

COD ID: 2242095
CIF file

HKL data

Formula: - C17 H18 N4 O2 -
Comments: Saranya, Sivaraj; Haribabu, Jebiti; Bhuvanesh, Nattamai S. P.; Karvembu, Ramasamy; Gayathri, Dasararaju Crystal structures of the Schiff base derivatives (<i>E</i>)-<i>N</i>'-[(1<i>H</i>-indol-3-yl)methylidene]isonicotinohydrazide ethanol monosolvate and (<i>E</i>)-<i>N</i>-methyl-2-[1-(2-oxo-2<i>H</i>-chromen-3-yl)ethylidene]hydrazinecarbothioamide Acta Crystallographica Section E 73(4) (2017) 594-597
Space group: P 21 21 21
Cell volume: 1576.8
Cell parameters: 9.4692; 9.9821; 16.682; 90; 90; 90;  

COD ID: 2242096
CIF file

HKL data

Original IUCr paper

Formula: - C H5 I N2 -
Comments: Petrov, Andrey A.; Goodilin, Eugene A.; Tarasov, Alexey B.; Lazarenko, Vladimir A.; Dorovatovskii, Pavel V.; Khrustalev, Victor N. Formamidinium iodide: crystal structure and phase transitions Acta Crystallographica Section E 73(4) (2017) 569-572
Space group: P 1 21/c 1
Cell volume: 461.06
Cell parameters: 4.8211; 13.776; 7.0113; 90; 98.06; 90;  

COD ID: 2242097
CIF file

HKL data

Original IUCr paper

Formula: - C19 H24 Cl2 N2 O4 Pt -
Comments: Le Thi Hong, Hai; Nguyen Thu, Thao; Nguyen, Hien; Van Meervelt, Luc Crystal structures of two platinum(II) complexes containing ethyl eugenoxyacetate and 2-aminopyridine Acta Crystallographica Section E 73(4) (2017) 573-578
Space group: P -1
Cell volume: 1037.76
Cell parameters: 8.3187; 11.4119; 12.1012; 70.437; 73.688; 87.038;  

COD ID: 2242098
CIF file

HKL data

Original IUCr paper

Formula: - C19 H23 Cl N2 O4 Pt -
Comments: Le Thi Hong, Hai; Nguyen Thu, Thao; Nguyen, Hien; Van Meervelt, Luc Crystal structures of two platinum(II) complexes containing ethyl eugenoxyacetate and 2-aminopyridine Acta Crystallographica Section E 73(4) (2017) 573-578
Space group: P 1 21/c 1
Cell volume: 1921.72
Cell parameters: 15.1198; 10.0855; 14.1855; 90; 117.329; 90;  

COD ID: 2242099
CIF file

HKL data

Original IUCr paper

Formula: - C7 H14 N4 O6 -
Comments: Wardell, James L.; Jotani, Mukesh M.; Tiekink, Edward R. T. Hydrazinium 2-amino-4-nitrobenzoate dihydrate: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(4) (2017) 579-585
Space group: P -1
Cell volume: 542.23
Cell parameters: 6.9695; 8.096; 10.5316; 76.468; 73.251; 75.39;  

COD ID: 2242100
CIF file

HKL data

Original IUCr paper

Formula: - C34 H44 Cl4 Hg N4 -
Comments: Rani, Varsha; Singh, Harkesh B.; Butcher, Ray J. Structure of 2,2'-(5-<i>tert</i>-butyl-1,3-phenylene)bis(1-pentyl-1<i>H</i>-benzimidazol-3-ium) tetrachloridomercurate(II) Acta Crystallographica Section E 73(4) (2017) 560-563
Space group: P -1
Cell volume: 1776.4
Cell parameters: 9.806; 11.264; 17.274; 96.727; 95.859; 108.575;  

COD ID: 2242101
CIF file

HKL data

Original IUCr paper

Formula: - Ge0.9375 Sb0.0725 -
Comments: Herrero, Adrian Gómez; Hammoudi, Lamia; Kars, Mohammed; Roisnel, Thierry; Otero-Diáz, L. Carlos Une surstructure de α-Ge, type diamant, induite par un dopage d'antimoine Acta Crystallographica Section E 73(5) (2017) 654-657
Space group: F -4 3 m
Cell volume: 1433.7
Cell parameters: 11.276; 11.276; 11.276; 90; 90; 90;  

COD ID: 2242102
CIF file

Original IUCr paper

Formula: - C8 H6 N4 O8 -
Comments: Sausa, Rosario C.; Pesce-Rodriguez, Rose A.; Wingard, Leah A.; Guzmán, Pablo E.; Sabatini, Jesse J. Crystal structure of 3,3'-biisoxazole-5,5'-bis(methylene) dinitrate (BIDN) Acta Crystallographica Section E 73(4) (2017) 644-646
Space group: P 1 21/n 1
Cell volume: 590.65
Cell parameters: 6.1917; 5.5299; 17.4769; 90; 99.233; 90;  

COD ID: 2242103
CIF file

Original IUCr paper

Formula: - C14 H21 N O9 -
Comments: Silva, Bruno Leonardo; Alves, Ricardo José; Speziali, Nivaldo Lúcio Crystal structure of 4-nitrophenyl 6-<i>O</i>-ethyl-β-<small>D</small>-galactopyranoside monohydrate Acta Crystallographica Section E 73(4) (2017) 598-601
Space group: P 21 21 21
Cell volume: 1624.99
Cell parameters: 5.1628; 8.1593; 38.5755; 90; 90; 90;  

COD ID: 2242104
CIF file

Original IUCr paper

Formula: - C15 H16 N3 O3.5 -
Comments: Chidan Kumar, C. S.; Sim, Ai Jia; Ng, Weng Zhun; Chia, Tze Shyang; Loh, Wan-Sin; Kwong, Huey Chong; Quah, Ching Kheng; Naveen, S.; Lokanath, N. K.; Warad, Ismail The crystal structure of zwitterionic 2-{[(4-iminiumyl-3-methyl-1,4-dihydropyridin-1-yl)methyl]carbamoyl}benzoate hemihydrate Acta Crystallographica, Section E 73(7) (2017) 927-931
Space group: C 1 2/c 1
Cell volume: 5675.8
Cell parameters: 21.3157; 11.9883; 22.8642; 90; 103.729; 90;  

COD ID: 2242105
CIF file

Original IUCr paper

Formula: - C11 H12 N2 -
Comments: Nieto, Carla I.; Claramunt, Rosa M.; Torralba, M. Carmen; Torres, M. Rosario; Elguero, Jose Crystal structure of (1<i>Z</i>,4<i>Z</i>)-2,4-dimethyl-3<i>H</i>-benzo[<i>b</i>][1,4]diazepine Acta Crystallographica, Section E 73(5) (2017) 647-650
Space group: P 1 21/c 1
Cell volume: 952.4
Cell parameters: 11.8226; 6.6305; 13.3557; 90; 114.531; 90;  

COD ID: 2242106
CIF file

Original IUCr paper

Formula: - C18 H24 Cl2 F2 O2 S2 Sn -
Comments: Nur Adibah Binti Mohd Amin; Rusnah Syahila Duali Hussen; Lee, See Mun; Halcovitch, Nathan R.; Jotani, Mukesh M.; Tiekink, Edward R. T. <i>trans</i>-Dichloridobis(dimethyl sulfoxide-κ<i>O</i>)bis(4-fluorobenzyl-κ<i>C</i>^1^)tin(IV): crystal structure and Hirshfeld surface analysis Acta Crystallographica, Section E 73(5) (2017) 667-672
Space group: P 1 21/c 1
Cell volume: 1118.28
Cell parameters: 8.2363; 12.702; 11.4038; 90; 110.391; 90;  

COD ID: 2242107
CIF file

HKL data

Original IUCr paper

Formula: - C18 H20 N2 O7 -
Comments: Soto-Monsalve, Mónica; Romero, Elkin L.; Zuluaga, Fabio; Chaur, Manuel N.; D'Vries, Richard F. (<i>E</i>)-5-[1-Hydroxy-3-(3,4,5-trimethoxyphenyl)allylidene]-1,3-dimethylpyrimidine-2,4,6-trione: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(8) (2017) 1197-1201
Space group: P -1
Cell volume: 887.04
Cell parameters: 7.9989; 8.0659; 14.6533; 104.52; 98.422; 98.909;  

COD ID: 2242108
CIF file

HKL data

Original IUCr paper

Formula: - C45 H75 Cl3 F12 Mo N2 O8 S4 -
Comments: Gapinska, Agata; Lough, Alan J.; Fekl, Ulrich Coordination compounds containing bis-dithiolene-chelated molybdenum(IV) and oxalate: comparison of terminal with bridging oxalate Acta Crystallographica Section E 73(8) (2017) 1202-1207
Space group: P 21 21 21
Cell volume: 6130.3
Cell parameters: 15.3879; 17.8733; 22.2895; 90; 90; 90;  

COD ID: 2242109
CIF file

HKL data

Formula: - C50 H72 F24 Mo2 N2 O4 S8 -
Comments: Gapinska, Agata; Lough, Alan J.; Fekl, Ulrich Coordination compounds containing bis-dithiolene-chelated molybdenum(IV) and oxalate: comparison of terminal with bridging oxalate Acta Crystallographica Section E 73(8) (2017) 1202-1207
Space group: P 1 21/n 1
Cell volume: 3892.5
Cell parameters: 14.2347; 19.494; 14.4056; 90; 103.159; 90;  

COD ID: 2242110
CIF file

HKL data

Formula: - C29 H30 N2 O6 -
Comments: Gotoh, Kazuma; Ishida, Hiroyuki Crystal structures of 4-methoxybenzoic acid‒1,3-bis(pyridin-4-yl)propane (2/1) and biphenyl-4,4'-dicarboxylic acid‒4-methoxypyridine (1/2) Acta Crystallographica Section E 73(8) (2017) 1192-1196
Space group: P -1
Cell volume: 1238.8
Cell parameters: 7.759; 8.733; 19.904; 91.087; 90.593; 113.241;  

COD ID: 2242111
CIF file

HKL data

Formula: - C26 H24 N2 O6 -
Comments: Gotoh, Kazuma; Ishida, Hiroyuki Crystal structures of 4-methoxybenzoic acid‒1,3-bis(pyridin-4-yl)propane (2/1) and biphenyl-4,4'-dicarboxylic acid‒4-methoxypyridine (1/2) Acta Crystallographica Section E 73(8) (2017) 1192-1196
Space group: P 1 21/c 1
Cell volume: 2193
Cell parameters: 18.354; 7.4166; 16.674; 90; 104.943; 90;  

COD ID: 2242112
CIF file

HKL data

Original IUCr paper

Formula: - C12 H15 N O -
Comments: Donkeng Dazie, Joel; Ludvík, Jiří; Fábry, Jan; Eigner, Václav Crystal structure of 2-<i>tert</i>-butyl-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]pyrrol-1-one Acta Crystallographica Section E 73(8) (2017) 1184-1188
Space group: P 1 21/n 1
Cell volume: 2086.6
Cell parameters: 6.044; 32.6938; 10.5679; 90; 92.266; 90;  

COD ID: 2242113
CIF file

HKL data

Formula: - C23 H14 N2 -
Comments: Faizi, Md. Serajul Haque; Dege, Necmi; Malinkin, S. Crystal structure and DFT study of 2-(pyren-1-yl)-1<i>H</i>-benzimidazole Acta Crystallographica Section E 73(8) (2017) 1180-1183
Space group: P b c a
Cell volume: 3051.9
Cell parameters: 8.7344; 9.5967; 36.41; 90; 90; 90;  

COD ID: 2242114
CIF file

HKL data

Original IUCr paper

Formula: - C20 H15 N O2 S -
Comments: Yennawar, Hemant P.; Fox, Ryan; Moyer, Quentin J.; Yang, Ziwei; Silverberg, Lee J. Crystal structure of 2,3-diphenyl-2,3-dihydro-4<i>H</i>-1,3-benzothiazin-4-one 1-oxide Acta Crystallographica Section E 73(8) (2017) 1189-1191
Space group: P 1 21/n 1
Cell volume: 1639.1
Cell parameters: 9.1505; 11.2712; 16.379; 90; 103.997; 90;  

COD ID: 2242115
CIF file

HKL data

Original IUCr paper

Formula: - C44.5 H40 N8 O4.5 Zn -
Comments: Burlov, Anatoliy S.; Vlasenko, Valery G.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N. Crystal structure of bis{1-phenyl-3-methyl-4-[(quinolin-3-yl)iminomethyl-κ<i>N</i>]-1<i>H</i>-pyrazol-5-olato-κ<i>O</i>}zinc methanol 2.5-solvate from synchrotron X-ray diffraction Acta Crystallographica Section E 73(8) (2017) 1208-1212
Space group: P -1
Cell volume: 3618
Cell parameters: 15.569; 16.994; 17.035; 111.56; 114.71; 96.3;  

COD ID: 2242116
CIF file

HKL data

Original IUCr paper

Formula: - C10 H12 Cl N O2 -
Comments: Baillargeon, Pierre; Rahem, Tarik; Caron-Duval, Édouard; Tremblay, Jacob; Fortin, Cloé; Blais, Étienne; Fan, Victor; Fortin, Daniel; Dory, Yves L. Isomorphous crystal structures of chlorodiacetylene and iododiacetylene derivatives: simultaneous hydrogen and halogen bonds on carbonyl Acta Crystallographica Section E 73(8) (2017) 1175-1179
Space group: P 1 21/c 1
Cell volume: 1105.8
Cell parameters: 10.336; 9.171; 11.87; 90; 100.656; 90;  

COD ID: 2242117
CIF file

HKL data

Original IUCr paper

Formula: - C10 H12 I N O2 -
Comments: Baillargeon, Pierre; Rahem, Tarik; Caron-Duval, Édouard; Tremblay, Jacob; Fortin, Cloé; Blais, Étienne; Fan, Victor; Fortin, Daniel; Dory, Yves L. Isomorphous crystal structures of chlorodiacetylene and iododiacetylene derivatives: simultaneous hydrogen and halogen bonds on carbonyl Acta Crystallographica Section E 73(8) (2017) 1175-1179
Space group: P 1 21/n 1
Cell volume: 1239.4
Cell parameters: 11.1587; 9.0288; 12.9899; 90; 108.731; 90;  

COD ID: 2242118
CIF file

HKL data

Original IUCr paper

Formula: - C19 H19 Br O2 -
Comments: Maragatham, Gunasekaran; Selvarani, Sivasamy; Rajakumar, Perumal; Lakshmi, Srinivasakannan Crystal structures of three 1-[4-(4-bromobutoxy)phenyl] chalcone derivatives: (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-phenylprop-2-en-1-one, (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one and (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one Acta Crystallographica Section E 73(8) (2017) 1232-1236
Space group: P 1 21/c 1
Cell volume: 1661.4
Cell parameters: 5.8266; 38.743; 7.5613; 90; 103.257; 90;  

COD ID: 2242119
CIF file

HKL data

Original IUCr paper

Formula: - C20 H21 Br O3 -
Comments: Maragatham, Gunasekaran; Selvarani, Sivasamy; Rajakumar, Perumal; Lakshmi, Srinivasakannan Crystal structures of three 1-[4-(4-bromobutoxy)phenyl] chalcone derivatives: (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-phenylprop-2-en-1-one, (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one and (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one Acta Crystallographica Section E 73(8) (2017) 1232-1236
Space group: P 1 21/c 1
Cell volume: 1791.27
Cell parameters: 5.7331; 41.732; 7.6476; 90; 101.767; 90;  

COD ID: 2242120
CIF file

HKL data

Original IUCr paper

Formula: - C21 H23 Br O4 -
Comments: Maragatham, Gunasekaran; Selvarani, Sivasamy; Rajakumar, Perumal; Lakshmi, Srinivasakannan Crystal structures of three 1-[4-(4-bromobutoxy)phenyl] chalcone derivatives: (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-phenylprop-2-en-1-one, (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one and (<i>E</i>)-1-[4-(4-bromobutoxy)phenyl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one Acta Crystallographica Section E 73(8) (2017) 1232-1236
Space group: P 1 21/c 1
Cell volume: 1944.98
Cell parameters: 9.4765; 26.0984; 7.8666; 90; 91.427; 90;  

COD ID: 2242121
CIF file

HKL data

Original IUCr paper

Formula: - C14 H17 N O4 -
Comments: Zukerman-Schpector, Julio; Sugiyama, Fabricia H.; Garcia, Ariel L. L.; Correia, Carlos Roque D.; Jotani, Mukesh M.; Tiekink, Edward R. T. Ethyl 2-(4-methoxyphenyl)-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate: crystal structure and Hirshfeld analysis Acta Crystallographica Section E 73(8) (2017) 1218-1222
Space group: P 1 21/c 1
Cell volume: 1355.79
Cell parameters: 9.6467; 18.408; 7.8076; 90; 102.071; 90;  

COD ID: 2242122
CIF file

HKL data

Original IUCr paper

Formula: - C5 H6 Cl N3 -
Comments: Sulovari, Aron; Tanski, Joseph M. Crystallographic and spectroscopic characterization of 5-chloropyridine-2,3-diamine Acta Crystallographica Section E 73(8) (2017) 1213-1217
Space group: P 21 21 21
Cell volume: 599.7
Cell parameters: 3.7565; 8.7002; 18.35; 90; 90; 90;  

COD ID: 2242123
CIF file

HKL data

Original IUCr paper

Formula: - C10 H18 O2 -
Comments: Collis, Gavin E.; Unterweger, Birgit; Dumsday, Geoff J.; Forsyth, Craig M. Structural elucidation of a hydroxy‒cineole product obtained from cytochrome P450 monooxygenase CYP101J2 catalysed transformation of 1,8-cineole Acta Crystallographica Section E 73(8) (2017) 1242-1245
Space group: P 1 21 1
Cell volume: 493.57
Cell parameters: 6.3121; 10.5611; 7.9925; 90; 112.126; 90;  

COD ID: 2242124
CIF file

HKL data

Original IUCr paper

Formula: - C18 H18 O2 -
Comments: Frampton, Christopher S.; MacNicol, David D. Structure of Equilenin at 100K: an estrone-related steroid Acta Crystallographica Section E 73(8) (2017) 1223-1226
Space group: P 21 21 21
Cell volume: 1360.57
Cell parameters: 7.27709; 7.32686; 25.5179; 90; 90; 90;  

COD ID: 2242125
CIF file

HKL data

Original IUCr paper

Formula: - C26 H24 N2 O2 -
Comments: Rivera, Augusto; Cepeda-Santamaría, Juan E.; Ríos-Motta, Jaime; Bolte, Michael Crystal structure of 2,2'-(ethane-1,2-diyl)bis(2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazine): a prospective raw material for polybenzoxazines Acta Crystallographica Section E 73(6) (2017) 832-834
Space group: P 1 21/c 1
Cell volume: 977.87
Cell parameters: 9.8658; 5.0979; 19.551; 90; 96.033; 90;  

COD ID: 2242126
CIF file Formula: - B18 Ba8.35 O36 Pb0.65 -
Comments: Zhao, Wenwu Crystal structure of the solid solution Ba~8.35~Pb~0.65~(B~3~O~6~)~6~ Acta Crystallographica Section E 73(3) (2017) 349-353
Space group: R -3 :H
Cell volume: 838.8
Cell parameters: 7.206; 7.206; 18.653; 90; 90; 120;  

COD ID: 2242127
CIF file

HKL data

Original IUCr paper

Formula: - C30 H44 O5 -
Comments: Bankeu Kezetas, Jean Jules; Dietagoum Madjouka, Stéphanie; Kumar, Rajesh; Ali, Muhammad Shaiq; Lenta Njakou, Bruno; Yousuf, Sammer Crystal structure and Hirshfeld surface analysis of 3-oxours-12-ene-27a,28-dioic acid (quafrinoic acid) Acta Crystallographica Section E 73(5) (2017) 763-766
Space group: P 1 21 1
Cell volume: 1318.22
Cell parameters: 8.3465; 10.9783; 14.6583; 90; 101.056; 90;  

COD ID: 2242128
CIF file

HKL data

Original IUCr paper

Formula: - C24 H20 Br N O3 -
Comments: Stephenson, Clifton J.; Mague, Joel T.; Kamm, Nathaniel; Aleman, Nathalie; Rich, Dayla; Dang, Quynh-Nhu; Nguyen, Ha Van Synthesis, resolution and crystal structures of two enantiomeric rhodamine derivatives Acta Crystallographica Section E 73(3) (2017) 327-333
Space group: P -1
Cell volume: 1001.6
Cell parameters: 8.3074; 11.1871; 11.7693; 102.384; 91.106; 109.581;  

COD ID: 2242129
CIF file

HKL data

Original IUCr paper

Formula: - C24 H20 Br N O3 -
Comments: Stephenson, Clifton J.; Mague, Joel T.; Kamm, Nathaniel; Aleman, Nathalie; Rich, Dayla; Dang, Quynh-Nhu; Nguyen, Ha Van Synthesis, resolution and crystal structures of two enantiomeric rhodamine derivatives Acta Crystallographica Section E 73(3) (2017) 327-333
Space group: P 21 21 21
Cell volume: 2010.1
Cell parameters: 11.0772; 13.0582; 13.8966; 90; 90; 90;  

COD ID: 2242130
CIF file

HKL data

Original IUCr paper

Formula: - C24 H20 Br N O3 -
Comments: Stephenson, Clifton J.; Mague, Joel T.; Kamm, Nathaniel; Aleman, Nathalie; Rich, Dayla; Dang, Quynh-Nhu; Nguyen, Ha Van Synthesis, resolution and crystal structures of two enantiomeric rhodamine derivatives Acta Crystallographica Section E 73(3) (2017) 327-333
Space group: P 21 21 21
Cell volume: 3982.3
Cell parameters: 8.1529; 18.185; 26.86; 90; 90; 90;  

COD ID: 2242131
CIF file

HKL data

Original IUCr paper

Formula: - C10 H14 Cl3 N O5 -
Comments: Oishi, Takeshi; Kidena, Mayu; Sugai, Tomoya; Sato, Takaaki; Chida, Noritaka Crystal structure of (‒)-methyl (<i>R</i>,<i>E</i>)-4-[(2<i>R</i>,4<i>R</i>)-2-amino-2-trichloromethyl-1,3-dioxolan-4-yl]-4-hydroxy-2-methylbut-2-enoate Acta Crystallographica Section E 73(7) (2017) 983-986
Space group: P 1 21 1
Cell volume: 684.23
Cell parameters: 5.8494; 12.6458; 9.5658; 90; 104.763; 90;  

COD ID: 2242132
CIF file

HKL data

Original IUCr paper

Formula: - C9 H9 Cl N2 O -
Comments: Hübscher, Jörg; Seichter, Wilhelm; Weber, Edwin Crystal structure of 2-chloro-5-(3-hydroxy-3-methylbut-1-yn-1-yl)pyrimidine Acta Crystallographica Section E 73(8) (2017) 1172-1174
Space group: P 1 21/n 1
Cell volume: 958.24
Cell parameters: 7.5555; 13.0278; 9.7397; 90; 91.767; 90;  

COD ID: 2242133
CIF file

HKL data

Original IUCr paper

Formula: - C17 H12 Br N3 O2 -
Comments: Vrijdag, Johannes; Van den Bogaert, An; De Borggraeve, Wim; Van Meervelt, Luc Crystal structure of 5-benzyl-8-bromo-2-methyl-1,3-oxazolo[4,5-<i>c</i>][1,8]naphthyridin-4(5<i>H</i>)-one Acta Crystallographica Section E 73(5) (2017) 687-690
Space group: P n a 21
Cell volume: 1519.5
Cell parameters: 6.715; 13.504; 16.757; 90; 90; 90;  

COD ID: 2242134
CIF file

HKL data

Original IUCr paper

Formula: - C22 H30 Cl N O5 -
Comments: Menze, Aveary R.; Sinnott, Jefferson P.; Nazarenko, Alexander Y. Crystal structure of naltrexone chloride solvates with ethanol, propan-2-ol, and 2-methylpropan-2-ol Acta Crystallographica Section E 73(7) (2017) 1013-1020
Space group: P 1 21 1
Cell volume: 1028.35
Cell parameters: 8.6885; 7.9478; 15.3417; 90; 103.908; 90;  

COD ID: 2242135
CIF file

HKL data

Formula: - C23 H32 Cl N O5 -
Comments: Menze, Aveary R.; Sinnott, Jefferson P.; Nazarenko, Alexander Y. Crystal structure of naltrexone chloride solvates with ethanol, propan-2-ol, and 2-methylpropan-2-ol Acta Crystallographica Section E 73(7) (2017) 1013-1020
Space group: P 21 21 21
Cell volume: 2191.9
Cell parameters: 8.0297; 15.5449; 17.56; 90; 90; 90;  

COD ID: 2242136
CIF file

HKL data

Formula: - C24 H34 Cl N O5 -
Comments: Menze, Aveary R.; Sinnott, Jefferson P.; Nazarenko, Alexander Y. Crystal structure of naltrexone chloride solvates with ethanol, propan-2-ol, and 2-methylpropan-2-ol Acta Crystallographica Section E 73(7) (2017) 1013-1020
Space group: P 1 21 1
Cell volume: 2384.7
Cell parameters: 8.8487; 17.3281; 15.5702; 90; 92.702; 90;  

COD ID: 2242137
CIF file

HKL data

Original IUCr paper

Formula: - C16 H15 N3 O3 S2 -
Comments: Azzam, Rasha A.; Elgemeie, Galal H.; Elsayed, Rasha E.; Jones, Peter G. Crystal structure of <i>N</i>'-[2-(benzo[<i>d</i>]thiazol-2-yl)acetyl]-4-methylbenzenesulfonohydrazide Acta Crystallographica Section E 73(7) (2017) 1041-1043
Space group: P -1
Cell volume: 846.59
Cell parameters: 8.3436; 9.7591; 10.8815; 97.905; 98.142; 101.576;  

COD ID: 2242138
CIF file

HKL data

Original IUCr paper

Formula: - C15 H18 N2 O S2 -
Comments: Azzam, Rasha A.; Elgemeie, Galal H.; Ramadan, Rokia; Jones, Peter G. Crystal structure of 2-cyano-3,3-bis(ethylsulfanyl)-<i>N</i>-<i>o</i>-tolylacrylamide Acta Crystallographica Section E 73(5) (2017) 752-754
Space group: P 1 21/c 1
Cell volume: 1531.27
Cell parameters: 9.4104; 12.835; 13.0774; 90; 104.198; 90;  

COD ID: 2242139
CIF file

HKL data

Original IUCr paper

Formula: - C10 H7 F N6 O8 -
Comments: Mohana, Marimuthu; Thomas Muthiah, Packianathan; McMillen, Colin D. Crystal structure and hydrogen-bonding patterns in 5-fluorocytosinium picrate Acta Crystallographica Section E 73(3) (2017) 361-364
Space group: P b c a
Cell volume: 2628.9
Cell parameters: 7.7463; 13.235; 25.642; 90; 90; 90;  

COD ID: 2242140
CIF file

HKL data

Original IUCr paper

Formula: - C32 H38 B2 F8 N6 Ni -
Comments: Chen, Lin; Ren, Gan; Guo, Yakun; Sang, Ge Crystal structure and electrochemical properties of [Ni(bztmpen)(CH~3~CN)](BF~4~)~2~ {bztmpen is <i>N</i>-benzyl-<i>N</i>,<i>N</i>',<i>N</i>'-tris[(6-methylpyridin-2-yl)methyl]ethane-1,2-diamine} Acta Crystallographica Section E 73(6) (2017) 825-828
Space group: C 1 c 1
Cell volume: 3405.8
Cell parameters: 11.23; 17.204; 18.11; 90; 103.248; 90;  

COD ID: 2242141
CIF file

HKL data

Original IUCr paper

Formula: - C14 H10 N2 O3 S -
Comments: Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Borges, Fernanda Polymorphism in the structure of <i>N</i>-(5-methylthiazol-2-yl)-4-oxo-4<i>H</i>-chromene-3-carboxamide Acta Crystallographica Section E 73(8) (2017) 1154-1161
Space group: P 1 21/n 1
Cell volume: 1281.86
Cell parameters: 4.8722; 12.0436; 21.9803; 90; 96.353; 90;  

COD ID: 2242142
CIF file

HKL data

Original IUCr paper

Formula: - C14 H10 N2 O3 S -
Comments: Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Borges, Fernanda Polymorphism in the structure of <i>N</i>-(5-methylthiazol-2-yl)-4-oxo-4<i>H</i>-chromene-3-carboxamide Acta Crystallographica Section E 73(8) (2017) 1154-1161
Space group: P 1 21/c 1
Cell volume: 2530.6
Cell parameters: 7.4646; 30.626; 11.0869; 90; 93.232; 90;  

COD ID: 2242143
CIF file

HKL data

Formula: - C18 H16 N6 O2 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen The crystal structures of three pyrazine-2,5-dicarboxamides: three-dimensional supramolecular structures Acta Crystallographica Section E 73(5) (2017) 729-734
Space group: P 1 21/c 1
Cell volume: 817.44
Cell parameters: 8.0769; 5.6076; 18.3724; 90; 100.781; 90;  

COD ID: 2242144
CIF file

HKL data

Formula: - C20 H20 N6 O2 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen The crystal structures of three pyrazine-2,5-dicarboxamides: three-dimensional supramolecular structures Acta Crystallographica Section E 73(5) (2017) 729-734
Space group: P 1 21/n 1
Cell volume: 917.01
Cell parameters: 8.7271; 5.295; 20.1403; 90; 99.834; 90;  

COD ID: 2242145
CIF file

HKL data

Formula: - C18 H16 N6 O2 -
Comments: Cati, Dilovan S.; Stoeckli-Evans, Helen The crystal structures of three pyrazine-2,5-dicarboxamides: three-dimensional supramolecular structures Acta Crystallographica Section E 73(5) (2017) 729-734
Space group: P 1 21/c 1
Cell volume: 786.08
Cell parameters: 5.8663; 18.7539; 7.2943; 90; 101.606; 90;  

COD ID: 2242146
CIF file

HKL data

Original IUCr paper

Formula: - C16 H40 N6 O4 S3 -
Comments: Döring, Cindy; Lueck, Julian F. D.; Jones, Peter G. Crystal structure of the 1:2 adduct of bis(piperidinium) sulfate and 1,3-dimethylthiourea Acta Crystallographica Section E 73(5) (2017) 651-653
Space group: C 1 2/c 1
Cell volume: 2580.51
Cell parameters: 12.5899; 17.5691; 11.898; 90; 101.326; 90;  

COD ID: 2242147
CIF file

HKL data

Original IUCr paper

Formula: - Mg7 Na3 O24 P6 Rb -
Comments: Ben Hamed, Teycir; Boukhris, Amal; Badri, Abdessalem; Ben Amara, Mongi Synthesis and crystal structure of a new magnesium phosphate Na~3~RbMg~7~(PO~4~)~6~ Acta Crystallographica Section E 73(6) (2017) 817-820
Space group: C 1 2/c 1
Cell volume: 1943.5
Cell parameters: 12.734; 10.685; 15.498; 90; 112.83; 90;  

COD ID: 2242148
CIF file

HKL data

Original IUCr paper

Formula: - C13 H15 N O2 -
Comments: Faizi, Md. Serajul Haque; Dege, Necmi; Malysheva, Maria L. Crystal structure and DFT study of 8-hydroxy-1,2,3,5,6,7-hexahydropyrido[3,2,1-<i>ij</i>]quinoline-9-carbaldehyde Acta Crystallographica Section E 73(5) (2017) 791-794
Space group: P 1 21/c 1
Cell volume: 1061
Cell parameters: 8.546; 9.137; 13.662; 90; 95.984; 90;  

COD ID: 2242149
CIF file

HKL data

Original IUCr paper

Formula: - C10 H30 Cr4 N4 O15 -
Comments: Moon, Dohyun; Choi, Jong-Ha Crystal structure of 1,4,8,11-tetraazoniacyclotetradecane bis(dichromate) monohydrate from synchrotron data Acta Crystallographica Section E 73(5) (2017) 755-758
Space group: P 1 21/c 1
Cell volume: 2247.6
Cell parameters: 10.428; 13.961; 15.49; 90; 94.671; 90;  

COD ID: 2242150
CIF file

HKL data

Original IUCr paper

Formula: - C12 H13 N3 -
Comments: Eberlin, Alex R.; Frampton, Christopher S. A metastable polymorphic form of the antifungal anilinopyrimidine active pyrimethanil Acta Crystallographica Section E 73(6) (2017) 886-889
Space group: P 1 21/n 1
Cell volume: 4355.6
Cell parameters: 10.5351; 19.1686; 22.1162; 90; 102.778; 90;  

COD ID: 2242151
CIF file

HKL data

Original IUCr paper

Formula: - C14 H13 N O2 -
Comments: Reuter, Hans; Okio, Coco K. Y. A. Crystal structure of (<i>E</i>)-2-hydroxy-1,2-diphenylethan-1-one oxime Acta Crystallographica Section E 73(7) (2017) 1062-1065
Space group: C 1 2/c 1
Cell volume: 2260.64
Cell parameters: 24.1434; 10.5348; 8.9006; 90; 93.042; 90;  

COD ID: 2242152
CIF file

HKL data

Original IUCr paper

Formula: - C21 H44 N4 O2 -
Comments: Moon, Dohyun; Choi, Jong-Ha Crystal structure of 9,20-dimethyl-1,8,12,19-tetraazatetracyclo[17.3.1.0^2,7^.0^13,18^]tricosane dihydrate from synchrotron X-ray data Acta Crystallographica Section E 73(3) (2017) 387-389
Space group: P -1
Cell volume: 1132.7
Cell parameters: 8.387; 10.275; 14.115; 87.2; 77.83; 72.31;  

COD ID: 2242153
CIF file

HKL data

Original IUCr paper

Formula: - Ca Fe Ni2 O12 P3 -
Comments: Ouaatta, Said; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structure of calcium dinickel(II) iron(III) tris(orthophosphate): CaNi~2~Fe(PO~4~)~3~ Acta Crystallographica Section E 73(6) (2017) 893-895
Space group: I m m a
Cell volume: 871
Cell parameters: 10.3126; 13.1138; 6.4405; 90; 90; 90;  

COD ID: 2242154
CIF file

HKL data

Original IUCr paper

Formula: - C14 H16 O3 -
Comments: Bauri, A. K.; Foro, S.; Rahman, A. F. M. M. Crystal structure of tetrahydroseselin, an angular pyranocoumarin Acta Crystallographica Section E 73(8) (2017) 1117-1120
Space group: P 1 21/c 1
Cell volume: 1221.2
Cell parameters: 7.282; 18.445; 9.144; 90; 96.11; 90;  

COD ID: 2242155
CIF file

HKL data

Original IUCr paper

Formula: - C17 H11 N3 -
Comments: Luong Thi Thu, Thuy; Nguyen Bich, Ngan; Nguyen, Hien; Van Meervelt, Luc Crystal structures of three 4-substituted-2,2'-bipyridines synthesized by Sonogashira and Suzuki‒Miyaura cross-coupling reactions Acta Crystallographica Section E 73(4) (2017) 610-615
Space group: P 1 21/c 1
Cell volume: 1369.7
Cell parameters: 3.7436; 34.146; 10.7528; 90; 94.799; 90;  

COD ID: 2242156
CIF file

HKL data

Original IUCr paper

Formula: - C18 H13 N3 -
Comments: Luong Thi Thu, Thuy; Nguyen Bich, Ngan; Nguyen, Hien; Van Meervelt, Luc Crystal structures of three 4-substituted-2,2'-bipyridines synthesized by Sonogashira and Suzuki‒Miyaura cross-coupling reactions Acta Crystallographica Section E 73(4) (2017) 610-615
Space group: P 1 21/c 1
Cell volume: 1321.28
Cell parameters: 9.6951; 12.0142; 12.0376; 90; 109.552; 90;  

COD ID: 2242157
CIF file

HKL data

Original IUCr paper

Formula: - C19 H14 N2 -
Comments: Luong Thi Thu, Thuy; Nguyen Bich, Ngan; Nguyen, Hien; Van Meervelt, Luc Crystal structures of three 4-substituted-2,2'-bipyridines synthesized by Sonogashira and Suzuki‒Miyaura cross-coupling reactions Acta Crystallographica Section E 73(4) (2017) 610-615
Space group: P 1 21/c 1
Cell volume: 2814.5
Cell parameters: 9.8697; 12.604; 22.8414; 90; 97.89; 90;  

COD ID: 2242158
CIF file

HKL data

Original IUCr paper

Formula: - C23 H28 N2 O8 S -
Comments: Wu, 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 73(6) (2017) 821-824
Space group: P 41 21 2
Cell volume: 5052.8
Cell parameters: 12.9905; 12.9905; 29.942; 90; 90; 90;  

COD ID: 2242159
CIF file

HKL data

Original IUCr paper

Formula: - C10 H12 N4 O -
Comments: Amenta, Donna S.; Liebing, Phil; Biero, Julia E.; Sherman, Robert J.; Gilje, John W.; Edelmann, Frank T. Synthesis and crystal structures of three new benzotriazolylpropanamides Acta Crystallographica Section E 73(6) (2017) 880-885
Space group: P -1
Cell volume: 500.37
Cell parameters: 7.3885; 8.072; 9.2976; 69.039; 89.498; 75.915;  

COD ID: 2242160
CIF file

HKL data

Formula: - C10 H12 N4 O -
Comments: Amenta, Donna S.; Liebing, Phil; Biero, Julia E.; Sherman, Robert J.; Gilje, John W.; Edelmann, Frank T. Synthesis and crystal structures of three new benzotriazolylpropanamides Acta Crystallographica Section E 73(6) (2017) 880-885
Space group: P -1
Cell volume: 510.2
Cell parameters: 5.5961; 9.3462; 10.472; 109.83; 90.93; 97.14;  

COD ID: 2242161
CIF file

HKL data

Formula: - C11 H14 N4 O -
Comments: Amenta, Donna S.; Liebing, Phil; Biero, Julia E.; Sherman, Robert J.; Gilje, John W.; Edelmann, Frank T. Synthesis and crystal structures of three new benzotriazolylpropanamides Acta Crystallographica Section E 73(6) (2017) 880-885
Space group: P -1
Cell volume: 540.25
Cell parameters: 7.1732; 7.9945; 9.5912; 83.91; 86.247; 81.528;  

COD ID: 2242162
CIF file

HKL data

Original IUCr paper

Formula: - C15 H10 Br N3 O2 S -
Comments: Bano, Huma; Hussain, Shafqat; Khan, Khalid M.; Perveen, Shahnaz; Yousuf, Sammer Crystal structure and Hirshfeld surface analysis of 1-(4-bromophenyl)-2-{[5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one Acta Crystallographica Section E 73(4) (2017) 623-626
Space group: P b c a
Cell volume: 3031.8
Cell parameters: 11.9144; 8.3755; 30.382; 90; 90; 90;  

COD ID: 2242163
CIF file

HKL data

Original IUCr paper

Formula: - C52 H66 Cl6 N10 Ni O2 -
Comments: Matthews, Morgan; Sendzik, Madison; Bruggeman, Adrienne; Kearns, Claire; Oliver, Allen G.; Babbini, Dominic C. Synthesis and crystal structure of a disubstituted nickel(II) bis[(dimethylaminophenylimino)ethyl]pyridine chloride complex Acta Crystallographica Section E 73(8) (2017) 1167-1171
Space group: P -1
Cell volume: 5475.4
Cell parameters: 13.2227; 17.7311; 24.0242; 79.6276; 81.2551; 89.3481;  

COD ID: 2242164
CIF file

HKL data

Original IUCr paper

Formula: - C28 H32 N2 -
Comments: Walbaum, Anqi; Fifer, E. Kim; Parkin, Sean; Crooks, Peter A. Crystal structure of 4,4'-bis[3-(piperidin-1-yl)prop-1-yn-1-yl]-1,1'-biphenyl Acta Crystallographica Section E 73(6) (2017) 864-866
Space group: C 1 2/c 1
Cell volume: 4488.63
Cell parameters: 40.2728; 6.9679; 16.0119; 90; 92.588; 90;  

COD ID: 2242165
CIF file

HKL data

Original IUCr paper

Formula: - C25 H16 N2 O2 -
Comments: Peña-Solórzano, Diana; König, Burkhard; Sierra, Cesar A.; Ochoa-Puentes, Cristian Crystal structure of <i>N</i>-(2-benzoyl-5-ethynylphenyl)quinoline-2-carboxamide Acta Crystallographica Section E 73(4) (2017) 602-605
Space group: P 1 21/c 1
Cell volume: 1846.83
Cell parameters: 20.2686; 7.58016; 12.6109; 90; 107.6; 90;  

COD ID: 2242166
CIF file

HKL data

Original IUCr paper

Formula: - Ba Fe Mn2 O12 P3 -
Comments: Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structures of two alkaline earth (<i>M</i> = Ba and Sr) dimanganese(II) iron(III) tris(orthophosphates) Acta Crystallographica Section E 73(5) (2017) 767-770
Space group: P b c n
Cell volume: 989.7
Cell parameters: 6.5899; 17.6467; 8.5106; 90; 90; 90;  

COD ID: 2242167
CIF file

HKL data

Original IUCr paper

Formula: - Fe Mn2 O12 P3 Sr -
Comments: Alhakmi, Ghaleb; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structures of two alkaline earth (<i>M</i> = Ba and Sr) dimanganese(II) iron(III) tris(orthophosphates) Acta Crystallographica Section E 73(5) (2017) 767-770
Space group: P b c n
Cell volume: 974.37
Cell parameters: 6.4304; 17.8462; 8.4906; 90; 90; 90;  

COD ID: 2242168
CIF file

HKL data

Original IUCr paper

Formula: - C4 H22 N4 O12 P4 Zn3 -
Comments: Katinaitė, Judita; Harrison, William T. A. The crystal structure of (C~2~H~9~N~2~)~2~[Zn~3~(HPO~3~)~4~], a three-dimensional zincophosphite framework containing 16-membered rings templated by the unsymmetrical dimethyl hydrazinium cation Acta Crystallographica Section E 73(5) (2017) 759-762
Space group: C 1 2/c 1
Cell volume: 2026.48
Cell parameters: 15.1154; 8.7269; 16.1675; 90; 108.156; 90;  

COD ID: 2242169
CIF file

HKL data

Original IUCr paper

Formula: - C43 H37 Ag Cl N3 O2 P2 S -
Comments: Nimthong-Roldán, Arunpatcha; Sripa, Paramee; Wattanakanjana, Yupa Crystal structure of chlorido[1-(4-nitrophenyl)thiourea-κ<i>S</i>]bis(triphenylphosphane-κ<i>P</i>)silver(I) Acta Crystallographica Section E 73(6) (2017) 829-831
Space group: P 1 21/c 1
Cell volume: 3928.57
Cell parameters: 11.8581; 28.5087; 12.0272; 90; 104.934; 90;  

COD ID: 2242170
CIF file

HKL data

Formula: - C10 H9 Cl N4 O S -
Comments: Velasques, Jecika Maciel; Gervini, Vanessa Carratu; Kickofel, Lisliane; de Farias, Renan Lira; de Oliveira, Adriano Bof Hirshfeld analysis and molecular docking with the RDR enzyme of 2-(5-chloro-2-oxoindolin-3-ylidene)-<i>N</i>-methylhydrazinecarbothioamide Acta Crystallographica Section E 73(5) (2017) 702-707
Space group: P 21 21 21
Cell volume: 1191.78
Cell parameters: 6.2584; 10.1734; 18.7183; 90; 90; 90;  

COD ID: 2242171
CIF file

HKL data

Original IUCr paper

Formula: - C27 H29 Cl7 Fe2 N4 O -
Comments: Swift, Hannah; Carrig, Molly W.; Oshin, Kayode D.; Vinokur, Anastasiya I.; Desper, John A.; Levy, Christopher J. Crystal structure of ({(1<i>R</i>,2<i>R</i>)-<i>N</i>,<i>N</i>'-bis[(quinolin-2-yl)methyl]cyclohexane-1,2-diamine}chloridoiron(III))-μ-oxido-[trichloridoferrate(III)] chloroform monosolvate Acta Crystallographica Section E 73(7) (2017) 936-940
Space group: P 21 21 21
Cell volume: 3190.9
Cell parameters: 10.3489; 14.3664; 21.4619; 90; 90; 90;  

COD ID: 2242172
CIF file

HKL data

Original IUCr paper

Formula: - C21 H9 F10 N3 -
Comments: Boyle, Jenna; Breakfield, Catherine; Buck, Leah; McMahon, Catherine; Babbini, Dominic C. Crystal structure of (1<i>E</i>,1'<i>E</i>)-1,1'-(pyridine-2,6-diyl)bis[<i>N</i>-(2,3,4,5,6-pentafluorophenyl)ethan-1-imine] Acta Crystallographica Section E 73(7) (2017) 954-956
Space group: P 1 21/m 1
Cell volume: 908.3
Cell parameters: 4.2713; 35.792; 5.9516; 90; 93.326; 90;  

COD ID: 2242173
CIF file

HKL data

Original IUCr paper

Formula: - C20 H24 N2 O4 -
Comments: Nguyen, Van Tuyen; Sorokina, Elena A.; Listratova, Anna V.; Voskressensky, Leonid G.; Lobanov, Nikolai N.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N. Ring-expansion synthesis and crystal structure of dimethyl 4-ethyl-1,4,5,6,7,8-hexahydroazonino[5,6-<i>b</i>]indole-2,3-dicarboxylate Acta Crystallographica Section E 73(3) (2017) 338-340
Space group: P 1 21/c 1
Cell volume: 1835.3
Cell parameters: 8.59; 10.45; 20.67; 90; 98.45; 90;  

COD ID: 2242174
CIF file

HKL data

Original IUCr paper

Formula: - C57 H52 Co N6 O6 -
Comments: Wu, Qi; He, Mingrui; Li, Jianfeng Crystal structure of (5-{3-[(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)carbonylamino]phenyl}-10,15,20-triphenylporphyrinato)cobalt(II) Acta Crystallographica Section E 73(7) (2017) 963-966
Space group: P 1 21/n 1
Cell volume: 4782.1
Cell parameters: 17.2445; 14.1398; 19.6452; 90; 93.3307; 90;  

COD ID: 2242175
CIF file

HKL data

Original IUCr paper

Formula: - C21 H28 N4 O -
Comments: Rivera, Augusto; Miranda-Carvajal, Ingrid; Ríos-Motta, Jaime; Bolte, Michael 1,3-Bis{(<i>E</i>)-[4-(dimethylamino)benzylidene]amino}propan-2-ol: chain structure formation <i>via</i> an O—H···N hydrogen bond Acta Crystallographica Section E 73(6) (2017) 813-816
Space group: P 1 21 1
Cell volume: 1918.9
Cell parameters: 9.1456; 10.586; 19.974; 90; 97.11; 90;  

COD ID: 2242176
CIF file

HKL data

Original IUCr paper

Formula: - C19 H17 B F3 P -
Comments: Bateman, Christopher M.; Zakharov, Lev N.; Abbey, Eric R. Crystal structure of triphenylphosphoniummethylenetrifluoroborate Acta Crystallographica Section E 73(8) (2017) 1140-1142
Space group: P -1
Cell volume: 836.8
Cell parameters: 9.514; 9.87; 9.883; 64.609; 87.539; 86.66;  

COD ID: 2242177
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 Br N3 O3 -
Comments: Lee, See Mun; Halcovitch, Nathan R.; Jotani, Mukesh M.; Tiekink, Edward R. T. <i>N</i>'-[1-(5-Bromo-2-hydroxyphenyl)ethylidene]isonicotinohydrazide monohydrate: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(4) (2017) 630-636
Space group: P -1
Cell volume: 698.57
Cell parameters: 7.1123; 7.7841; 13.3011; 87.604; 84.299; 72.447;  

COD ID: 2242178
CIF file

HKL data

Original IUCr paper

Formula: - C22 H30 Cl2 Cu N4 O8 -
Comments: Yang, Guang; Rybak-Akimova, Elena V.; Campana, Charles {1,1'-Bis[(pyridin-2-yl)methyl]-2,2'-bipiperidyl}(perchlorato)copper(II) perchlorate Acta Crystallographica Section E 73(7) (2017) 1082-1086
Space group: P 1 21/c 1
Cell volume: 4926.1
Cell parameters: 18.4079; 14.0001; 19.9387; 90; 106.531; 90;  

COD ID: 2242179
CIF file

HKL data

Original IUCr paper

Formula: - C16 H17 N3 O -
Comments: Sivajeyanthi, Palaniyappan; Jeevaraj, Muthaiah; Edison, Bellarmin; Balasubramani, Kasthuri Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-4-amino-<i>N</i>'-[1-(4-methylphenyl)ethylidene]benzohydrazide Acta Crystallographica Section E 73(7) (2017) 1029-1032
Space group: P 21 21 21
Cell volume: 1431.16
Cell parameters: 5.7011; 15.4836; 16.2128; 90; 90; 90;  

COD ID: 2242180
CIF file

HKL data

Original IUCr paper

Formula: - C49.71 H56.23 Cl6.19 Mn3 N6 O11.9 -
Comments: Egekenze, Rita; Gultneh, Yilma; Butcher, Ray J. Tris(μ~2~-methanolato)-μ~3~-oxido-tris{[(<i>E</i>)-4-chloro-2-({[2-(pyridin-2-yl)ethyl]imino}methyl)phenolato]manganese(III)} perchlorate‒dichloromethane‒diethyl ether (1/1.1/0.9) Acta Crystallographica Section E 73(8) (2017) 1113-1116
Space group: P 1 21/n 1
Cell volume: 5853.3
Cell parameters: 16.0002; 19.389; 19.1631; 90; 100.073; 90;  

COD ID: 2242181
CIF file

HKL data

Original IUCr paper

Formula: - C7 H10 O4 -
Comments: Tibhe, Gaurao D.; Macías, Mario A.; Pandolfi, Enrique; Schapiro, Valeria; Suescun, Leopoldo Crystal structure and absolute configuration of (4<i>S</i>,5<i>R</i>,6<i>S</i>)-4,5,6-trihydroxy-3-methylcyclohex-2-enone (gabosine H) Acta Crystallographica Section E 73(4) (2017) 606-609
Space group: P 1 21 1
Cell volume: 349.59
Cell parameters: 5.4143; 5.4176; 11.92; 90; 90.977; 90;  

COD ID: 2242182
CIF file

HKL data

Formula: - C11 H14 O3 -
Comments: Isaiev, Ivan; Shishkina, Svitlana; Ukrainets, Igor; Bevz, Elena Crystal structure of isopropyl 2-hydroxy-2-phenylacetate: a pharmacopoeia reference standard Acta Crystallographica Section E 73(5) (2017) 771-773
Space group: P 1 21/c 1
Cell volume: 1009.3
Cell parameters: 11.872; 15.165; 5.6079; 90; 91.41; 90;  

COD ID: 2242183
CIF file

HKL data

Original IUCr paper

Formula: - C8 H22 N4 P2 S2 -
Comments: Issaoui, Chokri; Chebbi, Hammouda; Alouani, Khaled; Guesmi, Abderrahmen Crystal structure and Hirshfeld surface analysis of the new cyclodiphosphazane [EtNP(S)NMe~2~]~2~ Acta Crystallographica Section E 73(5) (2017) 682-686
Space group: P 1 21/c 1
Cell volume: 789.8
Cell parameters: 7.1975; 11.448; 9.645; 90; 96.39; 90;  

COD ID: 2242184
CIF file

HKL data

Formula: - C30 H44 N2 O4 -
Comments: Im, Hansu; Choi, Myong Yong; Moon, Cheol Joo; Kim, Tae Ho Crystal structure of <i>N</i>,<i>N</i>'-didecylpyromellitic diimide Acta Crystallographica Section E 73(6) (2017) 838-841
Space group: P 1 21/c 1
Cell volume: 1370.11
Cell parameters: 30.6365; 5.0149; 8.9393; 90; 93.98; 90;  

COD ID: 2242185
CIF file

HKL data

Original IUCr paper

Formula: - C8 H24 Cl4 Cu N2 -
Comments: Seck, Gorgui Awa; Diop, Libasse; Oliver, Allen G. Crystal structure of the monoclinic phase (phase IV) of bis(tetramethylammonium) tetrachloridocuprate(II) Acta Crystallographica Section E 73(3) (2017) 358-360
Space group: P 1 21/n 1
Cell volume: 1613.65
Cell parameters: 8.9901; 12.0059; 14.957; 90; 91.719; 90;  

COD ID: 2242186
CIF file

HKL data

Original IUCr paper

Formula: - C15 H14 Br2 O4 -
Comments: Bauri, A. K.; Foro, Sabine; Rahman, A. F. M. M. Crystal structure of dibromomethoxyseselin (DBMS), a photobiologically active pyranocoumarin Acta Crystallographica Section E 73(5) (2017) 774-776
Space group: P -1
Cell volume: 758.4
Cell parameters: 7.119; 8.519; 13.366; 105.34; 90.45; 103.38;  

COD ID: 2242187
CIF file

HKL data

Original IUCr paper

Formula: - C9 H8 N2 O2 S3 -
Comments: Vu Quoc, Trung; Nguyen Ngoc, Linh; Nguyen Tien, Cong; Thang Pham, Chien; Van Meervelt, Luc Crystal structure of <i>N</i>-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-2-(thiophen-3-yl)acetamide Acta Crystallographica Section E 73(6) (2017) 901-904
Space group: P -1
Cell volume: 1149.42
Cell parameters: 9.6205; 10.8252; 11.5073; 97.836; 102.72; 95.047;  

COD ID: 2242188
CIF file

HKL data

Original IUCr paper

Formula: - C8 H5 F N2 O2 -
Comments: Martins, Bianca Barreto; Bresolin, Leandro; de Farias, Renan Lira; de Oliveira, Adriano Bof; Gervini, Vanessa Carratu Crystal structure, Hirshfeld analysis and molecular docking with the vascular endothelial growth factor receptor-2 of (3<i>Z</i>)-5-fluoro-3-(hydroxyimino)indolin-2-one Acta Crystallographica Section E 73(7) (2017) 987-992
Space group: P 1 21/c 1
Cell volume: 734.62
Cell parameters: 7.3036; 7.2045; 14.009; 90; 94.736; 90;  

COD ID: 2242189
CIF file

HKL data

Original IUCr paper

Formula: - C13 H10 F N3 O2 -
Comments: Jiajaroen, Suwadee; Chainok, Kittipong; Kielar, Filip Crystal structure of (<i>E</i>)-<i>N</i>'-(3-fluoro-2-hydroxybenzylidene)isonicotinohydrazide Acta Crystallographica Section E 73(8) (2017) 1151-1153
Space group: P 1 21/c 1
Cell volume: 1204.73
Cell parameters: 7.8555; 10.2748; 14.939; 90; 92.397; 90;  

COD ID: 2242190
CIF file

HKL data

Original IUCr paper

Formula: - C20 H17 Cl N2 O2 -
Comments: Khan, Tuhin; Mishra, Navneet; Mhatre, Darshan S.; Datta, Anindya Crystal structure and UV spectra of a 1,2-disubstituted benzimidazolium chloride Acta Crystallographica Section E 73(8) (2017) 1143-1147
Space group: P -1
Cell volume: 890.75
Cell parameters: 9.8002; 10.6791; 10.6986; 111.364; 102.346; 111.311;  

COD ID: 2242191
CIF file

HKL data

Original IUCr paper

Formula: - C17 H16 Fe N2 O4 -
Comments: Medved'ko, Aleksei V.; Churakov, Andrei V.; Yu, Haojie; Li, Wang; Vatsadze, Sergey Z. Crystal structure of 3-aminopyridinium 1'-carboxyferrocene-1-carboxylate Acta Crystallographica Section E 73(6) (2017) 856-858
Space group: P 1 21/c 1
Cell volume: 1566.5
Cell parameters: 13.2246; 10.304; 11.7402; 90; 101.703; 90;  

COD ID: 2242192
CIF file

HKL data

Original IUCr paper

Formula: - C31 H46 Cl4 N2 Pd -
Comments: Ellandula, Shravan Kumar; Opoku Amoako, Cosmos; Mague, Joel T.; Chandrasekaran, Perumalreddy Crystal structure of unsymmetrical α-diimine palladium(II) complex <i>cis</i>-[{ArN=C(Me)‒(Et)C=NAr}PdCl~2~] [Ar = 2,6-(iPr)~2~C~6~H~3~] Acta Crystallographica Section E 73(8) (2017) 1148-1150
Space group: P 1 21/c 1
Cell volume: 3370.2
Cell parameters: 8.7203; 20.124; 19.526; 90; 100.405; 90;  

COD ID: 2242193
CIF file

HKL data

Original IUCr paper

Formula: - C4 H6 N10 O2 -
Comments: Mitchell, Lauren A.; Imler, Gregory H.; Parrish, Damon A.; Deschamps, Jeffrey R.; Leonard, Philip W.; Chavez, David E. Crystal structures of the three closely related compounds: bis[(1<i>H</i>-tetrazol-5-yl)methyl]nitramide, triaminoguanidinium 5-({[(1<i>H</i>-tetrazol-5-yl)methyl](nitro)amino}methyl)tetrazol-1-ide, and diammonium bis[(tetrazol-1-id-5-yl)methyl]nitramide monohydrate Acta Crystallographica Section E 73(7) (2017) 1056-1061
Space group: P 1 21 1
Cell volume: 411.6
Cell parameters: 6.364; 9.627; 6.8627; 90; 101.805; 90;  

COD ID: 2242194
CIF file

HKL data

Original IUCr paper

Formula: - C5 H14 N16 O2 -
Comments: Mitchell, Lauren A.; Imler, Gregory H.; Parrish, Damon A.; Deschamps, Jeffrey R.; Leonard, Philip W.; Chavez, David E. Crystal structures of the three closely related compounds: bis[(1<i>H</i>-tetrazol-5-yl)methyl]nitramide, triaminoguanidinium 5-({[(1<i>H</i>-tetrazol-5-yl)methyl](nitro)amino}methyl)tetrazol-1-ide, and diammonium bis[(tetrazol-1-id-5-yl)methyl]nitramide monohydrate Acta Crystallographica Section E 73(7) (2017) 1056-1061
Space group: P 1 21/c 1
Cell volume: 1330.1
Cell parameters: 6.5312; 12.682; 16.183; 90; 97.118; 90;  

COD ID: 2242195
CIF file

HKL data

Original IUCr paper

Formula: - C4 H14 N12 O3 -
Comments: Mitchell, Lauren A.; Imler, Gregory H.; Parrish, Damon A.; Deschamps, Jeffrey R.; Leonard, Philip W.; Chavez, David E. Crystal structures of the three closely related compounds: bis[(1<i>H</i>-tetrazol-5-yl)methyl]nitramide, triaminoguanidinium 5-({[(1<i>H</i>-tetrazol-5-yl)methyl](nitro)amino}methyl)tetrazol-1-ide, and diammonium bis[(tetrazol-1-id-5-yl)methyl]nitramide monohydrate Acta Crystallographica Section E 73(7) (2017) 1056-1061
Space group: P -1
Cell volume: 585.29
Cell parameters: 7.5893; 7.6077; 11.2319; 85.564; 85.555; 65.007;  

COD ID: 2242196
CIF file

HKL data

Original IUCr paper

Formula: - C46 H37 O7 P3 Ru3 -
Comments: Kakizawa, Taeko Crystal structure of [1,2-bis(diphenylphosphanyl)benzene]heptacarbonyldi-μ-hydrido-(μ~3~-2,4,6-trimethylphenylphosphinidene)-<i>triangulo</i>-triruthenium Acta Crystallographica Section E 73(7) (2017) 945-948
Space group: P -1
Cell volume: 4293.07
Cell parameters: 10.9732; 19.4127; 22.1186; 114.172; 90.2641; 92.5256;  

COD ID: 2242197
CIF file

HKL data

Formula: - C14 H13 Cl2 N O2 S -
Comments: Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A. Crystal structures of isomeric 3,5-dichloro-<i>N</i>-(2,3-dimethylphenyl)benzenesulfonamide, 3,5-dichloro-<i>N</i>-(2,6-dimethylphenyl)benzenesulfonamide and 3,5-dichloro-<i>N</i>-(3,5-dimethylphenyl)benzenesulfonamide Acta Crystallographica Section E 73(5) (2017) 673-677
Space group: P 1 21/n 1
Cell volume: 1488.61
Cell parameters: 8.2223; 14.1546; 12.7933; 90; 91.188; 90;  

COD ID: 2242198
CIF file

HKL data

Formula: - C14 H13 Cl2 N O2 S -
Comments: Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A. Crystal structures of isomeric 3,5-dichloro-<i>N</i>-(2,3-dimethylphenyl)benzenesulfonamide, 3,5-dichloro-<i>N</i>-(2,6-dimethylphenyl)benzenesulfonamide and 3,5-dichloro-<i>N</i>-(3,5-dimethylphenyl)benzenesulfonamide Acta Crystallographica Section E 73(5) (2017) 673-677
Space group: P -1
Cell volume: 747.1
Cell parameters: 8.4817; 8.6149; 12.167; 109.875; 91.9; 114.19;  

COD ID: 2242199
CIF file

HKL data

Formula: - C14 H13 Cl2 N O2 S -
Comments: Shakuntala, K.; Naveen, S.; Lokanath, N. K.; Suchetan, P. A. Crystal structures of isomeric 3,5-dichloro-<i>N</i>-(2,3-dimethylphenyl)benzenesulfonamide, 3,5-dichloro-<i>N</i>-(2,6-dimethylphenyl)benzenesulfonamide and 3,5-dichloro-<i>N</i>-(3,5-dimethylphenyl)benzenesulfonamide Acta Crystallographica Section E 73(5) (2017) 673-677
Space group: P 1 21/c 1
Cell volume: 1465.7
Cell parameters: 12.2268; 7.0399; 17.313; 90; 100.409; 90;  

COD ID: 2242200
CIF file

HKL data

Original IUCr paper

Formula: - C38 H46 Cl2 N6 Ni O12 -
Comments: Fu, Wei-Wei; Li, Ya-Qian; Liu, Yang; Chen, Man-Sheng; Li, Wei; Yang, Ying-Qun An infinite two-dimensional hybrid water‒chloride network in a 4'-(furan-2-yl)-2,2':6',2''-terpyridine nickel(II) matrix Acta Crystallographica Section E 73(6) (2017) 871-875
Space group: P -1
Cell volume: 2095
Cell parameters: 10.351; 11.894; 19.07; 76.33; 88.582; 67.077;  

COD ID: 2242201
CIF file

HKL data

Original IUCr paper

Formula: - C12 H15 N O4 -
Comments: Chesna, Aaron M.; Cox, Jordan M.; Basso, Sanjukta; Benedict, Jason B. Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic <small>L</small>-proline Acta Crystallographica Section E 73(3) (2017) 369-371
Space group: P 21 21 21
Cell volume: 1148.3
Cell parameters: 5.6993; 12.0762; 16.6839; 90; 90; 90;  

COD ID: 2242202
CIF file

HKL data

Original IUCr paper

Formula: - C20 H26 O3 -
Comments: Ke, Rui-Fang; Xu, Shi-Cheng; Song, Ping; Deng, Shi-Hao; Ma, Xin-Hua; Yang, Xin-Zhou Crystal structure of taxodione isolated from <i>Taxodium ascendens</i> (B.) Acta Crystallographica Section E 73(7) (2017) 1102-1104
Space group: P 21 21 21
Cell volume: 1706.2
Cell parameters: 9.5008; 13.22; 13.584; 90; 90; 90;  

COD ID: 2242203
CIF file

HKL data

Original IUCr paper

Formula: - C26 H38 Cl N2 O P -
Comments: Veinot, Alex J.; Hendsbee, Arthur D.; Masuda, Jason D. Crystal structure of 2-chloro-1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-oxide Acta Crystallographica Section E 73(5) (2017) 735-737
Space group: P 1 21/n 1
Cell volume: 2555.4
Cell parameters: 19.984; 6.6328; 20.14; 90; 106.818; 90;  

COD ID: 2242204
CIF file

HKL data

Original IUCr paper

Formula: - C13 H16 O4 -
Comments: Vigier, Jordan; François, Camille; Pourchet, Sylvie; Boni, Gilles; Plasseraud, Laurent; Placet, Vincent; Fontaine, Stéphane; Cattey, Hélène Crystal structure of the diglycidyl ether of eugenol Acta Crystallographica Section E 73(5) (2017) 694-697
Space group: C 1 c 1
Cell volume: 1170.71
Cell parameters: 9.8262; 13.4434; 9.4251; 90; 109.897; 90;  

COD ID: 2242205
CIF file

HKL data

Original IUCr paper

Formula: - C9 H10 N2 O4 -
Comments: Vatsadze, Sergey Z.; Manaenkova, Marina A.; Vasilev, Evgeny V.; Venskovsky, Nikolai U.; Khrustalev, Victor N. Crystal structures and supramolecular features of 9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone, 3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane]-2,4,6,8-tetraone and 9-methyl-9-phenyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone dimethylformamide monosolvate Acta Crystallographica Section E 73(7) (2017) 1097-1101
Space group: C 1 2/c 1
Cell volume: 884
Cell parameters: 11.4321; 6.6263; 12.4819; 90; 110.788; 90;  

COD ID: 2242206
CIF file

HKL data

Original IUCr paper

Formula: - C11 H12 N2 O4 -
Comments: Vatsadze, Sergey Z.; Manaenkova, Marina A.; Vasilev, Evgeny V.; Venskovsky, Nikolai U.; Khrustalev, Victor N. Crystal structures and supramolecular features of 9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone, 3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane]-2,4,6,8-tetraone and 9-methyl-9-phenyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone dimethylformamide monosolvate Acta Crystallographica Section E 73(7) (2017) 1097-1101
Space group: P n m a
Cell volume: 1015.67
Cell parameters: 12.8058; 11.485; 6.9058; 90; 90; 90;  

COD ID: 2242207
CIF file

HKL data

Original IUCr paper

Formula: - C17 H19 N3 O5 -
Comments: Vatsadze, Sergey Z.; Manaenkova, Marina A.; Vasilev, Evgeny V.; Venskovsky, Nikolai U.; Khrustalev, Victor N. Crystal structures and supramolecular features of 9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone, 3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane]-2,4,6,8-tetraone and 9-methyl-9-phenyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone dimethylformamide monosolvate Acta Crystallographica Section E 73(7) (2017) 1097-1101
Space group: P b c a
Cell volume: 3302.8
Cell parameters: 7.7876; 19.4656; 21.7879; 90; 90; 90;  

COD ID: 2242208
CIF file

HKL data

Original IUCr paper

Formula: - C26 H25 Br Cl2 Hg N4 -
Comments: Rani, Varsha; Singh, Harkesh B.; Butcher, Ray J. Synthesis and structure of the mercury chloride complex of 2,2'-(2-bromo-5-<i>tert</i>-butyl-1,3-phenylene)bis(1-methyl-1<i>H</i>-benzimidazole) Acta Crystallographica Section E 73(3) (2017) 341-344
Space group: P 1 21/c 1
Cell volume: 2583.35
Cell parameters: 9.50481; 13.3872; 20.3322; 90; 93.0955; 90;  

COD ID: 2242209
CIF file

HKL data

Original IUCr paper

Formula: - C9 H10 O5 -
Comments: Elkin, Igor; Maris, Thierry; Hildgen, Patrice Synthesis and characterization of 3-methyl-6-[(propynyloxy)methyl]-1,4-dioxane-2,5-dione Acta Crystallographica Section E 73(7) (2017) 1044-1047
Space group: P 1 21/c 1
Cell volume: 923.66
Cell parameters: 6.9774; 6.8273; 19.4895; 90; 95.804; 90;  

COD ID: 2242210
CIF file

HKL data

Original IUCr paper

Formula: - C26 H25 N -
Comments: Al-Rubaye, Baidaa K.; Brink, Alice; Miller, Gary J.; Potgieter, Herman; Al-Jeboori, Mohamad J. Crystal structure of (<i>E</i>)-4-benzylidene-6-phenyl-1,2,3,4,7,8,9,10-octahydrophenanthridine Acta Crystallographica Section E 73(7) (2017) 1092-1096
Space group: P -1
Cell volume: 1887.2
Cell parameters: 11.0758; 12.4989; 14.2425; 98.088; 96.537; 102.151;  

COD ID: 2242211
CIF file

HKL data

Original IUCr paper

Formula: - C H O3 Rb -
Comments: Larvor, Carla; Stöger, Berthold The phase transition of rubidium hydrogen carbonate, RbHCO~3~ Acta Crystallographica Section E 73(7) (2017) 975-979
Space group: C 1 2/m 1
Cell volume: 335.9
Cell parameters: 14.807; 5.8216; 4.0217; 90; 104.321; 90;  

COD ID: 2242212
CIF file

HKL data

Original IUCr paper

Formula: - C H O3 Rb -
Comments: Larvor, Carla; Stöger, Berthold The phase transition of rubidium hydrogen carbonate, RbHCO~3~ Acta Crystallographica Section E 73(7) (2017) 975-979
Space group: C -1
Cell volume: 334.59
Cell parameters: 14.945; 5.8212; 3.9699; 89.343; 104.096; 92.748;  

COD ID: 2242213
CIF file

HKL data

Original IUCr paper

Formula: - C16 H52 Br6 N8 O14 Pt2 S4 -
Comments: Matsushita, Nobuyuki; Taira, Ayako; Taoka, Yoshiya A one-dimensional bromide-bridged Pt^II^/Pt^IV^ mixed-valence complex with a 2-bromoethanesulfonate counter-ion Acta Crystallographica Section E 73(8) (2017) 1108-1112
Space group: P 21 21 2
Cell volume: 2145.18
Cell parameters: 14.3568; 27.0628; 5.5212; 90; 90; 90;  

COD ID: 2242214
CIF file

HKL data

Original IUCr paper

Formula: - C26 H38 N5 P -
Comments: Veinot, Alex J.; Blair, Amber D.; Masuda, Jason D. Crystal structure of 2-azido-1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine Acta Crystallographica Section E 73(6) (2017) 905-907
Space group: P 1 21/n 1
Cell volume: 2609.7
Cell parameters: 10.0148; 17.343; 15.627; 90; 105.948; 90;  

COD ID: 2242215
CIF file

HKL data

Original IUCr paper

Formula: - C10 H10 N2 O3 -
Comments: Safyanova, Inna S.; Ohui, Kateryna A.; Omelchenko, Iryna V.; Shyshkina, Svitlana V. Crystal structure of <i>N</i>-hydroxyquinoline-2-carboxamide monohydrate Acta Crystallographica Section E 73(5) (2017) 795-797
Space group: C 1 2/c 1
Cell volume: 1903.7
Cell parameters: 21.613; 3.8867; 25.081; 90; 115.37; 90;  

COD ID: 2242216
CIF file

HKL data

Original IUCr paper

Formula: - C17 H11 F3 O4 -
Comments: Low, John Nicolson; Gomes, Ligia R.; Gaspar, Alexandra; Borges, Fernanda Structure of 7-hydroxy-3-(2-methoxyphenyl)-2-trifluoromethyl-4<i>H</i>-chromen-4-one Acta Crystallographica Section E 73(8) (2017) 1130-1134
Space group: P b c a
Cell volume: 2891.2
Cell parameters: 7.9147; 16.2171; 22.5254; 90; 90; 90;  

COD ID: 2242217
CIF file

HKL data

Original IUCr paper

Formula: - C19 H24 O6 -
Comments: Paz, Cristian; Ortiz, Leandro; Schilde, Uwe Crystal structure of erioflorin isolated from <i>Podanthus mitiqui</i> (L.) Acta Crystallographica Section E 73(3) (2017) 334-337
Space group: P 21 21 21
Cell volume: 1867.47
Cell parameters: 8.4709; 9.8287; 22.4299; 90; 90; 90;  

COD ID: 2242218
CIF file

HKL data

Original IUCr paper

Formula: - C29 H24 N2 O S -
Comments: Mahalakshmi, Vairavan; Gouthaman, Siddan; Sugunalakshmi, Madurai; Bargavi, Srinivasan; Lakshmi, Srinivasakannan Crystal structure of 10-ethyl-7-(9-ethyl-9<i>H</i>-carbazol-3-yl)-10<i>H</i>-phenothiazine-3-carbaldehyde Acta Crystallographica Section E 73(5) (2017) 726-728
Space group: P 1 21/n 1
Cell volume: 2264.1
Cell parameters: 9.4677; 25.7169; 9.5704; 90; 103.681; 90;  

COD ID: 2242219
CIF file

HKL data

Original IUCr paper

Formula: - C18 H18 I2 N2 O2 -
Comments: Rivera, Augusto; Rojas, Jicli José; Ríos-Motta, Jaime; Bolte, Michael C—I···N short contacts as tools for the construction of the crystal packing in the crystal structure of 3,3'-(ethane-1,2-diyl)bis(6-iodo-3,4-dihydro-2<i>H</i>-1,3-benzoxazine) Acta Crystallographica Section E 73(5) (2017) 664-666
Space group: C 1 2/c 1
Cell volume: 1804.69
Cell parameters: 20.42; 5.9477; 17.8414; 90; 123.607; 90;  

COD ID: 2242220
CIF file

HKL data

Formula: - C15 H16 O6 -
Comments: Bortoluzzi, Adailton J.; Silveira, Gustavo P.; Sá, Marcus M. Crystal structure of 5-<i>O</i>-benzoyl-2,3-<i>O</i>-isopropylidene-<small>D</small>-ribono-1,4-lactone Acta Crystallographica Section E 73(3) (2017) 407-409
Space group: P 21 21 21
Cell volume: 1461.11
Cell parameters: 5.7574; 12.5703; 20.1888; 90; 90; 90;  

COD ID: 2242221
CIF file

HKL data

Original IUCr paper

Formula: - Ag6.62 Co6.56 Fe5.44 O48 P12 -
Comments: Bouraima, Adam; Makani, Thomas; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen Crystal structure of a silver-, cobalt- and iron-based phosphate with an alluaudite-like structure: Ag~1.655~Co~1.64~Fe~1.36~(PO~4~)~3~ Acta Crystallographica Section E 73(6) (2017) 890-892
Space group: C 1 2/c 1
Cell volume: 876.09
Cell parameters: 11.868; 12.5514; 6.4386; 90; 114.012; 90;  

COD ID: 2242222
CIF file

HKL data

Original IUCr paper

Formula: - C11 H27 Co F12 N4 P2 S3 -
Comments: Fukuda, Yosuke; Yoshinari, Nobuto; Konno, Takumi Synthesis and crystallographic characterization of a mononuclear cobalt(III) complex possessing both thiolate and thioether donors: reactivity of an thiolate-bridged pentanuclear Co~2~Ag~3~ complex with iodomethane Acta Crystallographica Section E 73(5) (2017) 678-681
Space group: C 1 2/c 1
Cell volume: 9358.1
Cell parameters: 32.44; 10.3197; 29.869; 90; 110.629; 90;  

COD ID: 2242223
CIF file

HKL data

Original IUCr paper

Formula: - C14 H15 I N2 O -
Comments: Drebushchak, T. N.; Kryukov, Yu.A.; Rogova, A. I.; Boldyreva, E. V. Crystal structure of 4-benzylcarbamoyl-1-methylpyridin-1-ium iodide: an efficient multimodal antiviral drug Acta Crystallographica Section E 73(7) (2017) 967-970
Space group: P 21 21 21
Cell volume: 1444.46
Cell parameters: 9.2867; 10.8741; 14.3038; 90; 90; 90;  

COD ID: 2242224
CIF file

HKL data

Original IUCr paper

Formula: - C19 H21 N O4 S2 -
Comments: Umeda, Daiki; Putra, Okky Dwichandra; Gunji, Mihoko; Fukuzawa, Kaori; Yonemochi, Etsuo Epalrestat tetrahydrofuran monosolvate: crystal structure and phase transition Acta Crystallographica Section E 73(7) (2017) 941-944
Space group: P -1
Cell volume: 933.23
Cell parameters: 7.8956; 8.9627; 15.0311; 102.263; 93.97; 114.219;  

COD ID: 2242225
CIF file

HKL data

Original IUCr paper

Formula: - C28 H32 B N3 -
Comments: Yang, Lijing; Drew, Brett; Yalagala, Ravi Shekar; Chaviwala, Rameez; Simionescu, Razvan; Lough, Alan J.; Yan, Hongbin Crystal structure and solvent-dependent behaviours of 3-amino-1,6-diethyl-2,5,7-trimethyl-4,4-diphenyl-3a,4a-diaza-4-bora-<i>s</i>-indacene Acta Crystallographica Section E 73(3) (2017) 378-382
Space group: P 1 21 1
Cell volume: 1173.45
Cell parameters: 9.4938; 11.5325; 11.3739; 90; 109.557; 90;  

COD ID: 2242226
CIF file

HKL data

Formula: - C11 H18 O4 -
Comments: Morales-Rivera, Keyla F.; Piñero Cruz, Dalice M.; Prieto, Jose A. Crystal structure of ({-})-(<i>S</i>)-4-[(2<i>S</i>,3<i>S</i>,4<i>S</i>,<i>Z</i>)-3-hydroxy-4-methylhept-5-en-2-yl]-1,3-dioxolan-2-one Acta Crystallographica Section E 73(7) (2017) 1070-1072
Space group: P 21 21 21
Cell volume: 1150.44
Cell parameters: 5.0968; 8.8153; 25.6052; 90; 90; 90;  

COD ID: 2242227
CIF file

HKL data

Original IUCr paper

Formula: - C23 H26 O5 -
Comments: Kuz'mina, Lyudmila G.; Konstantinov, Ivan I.; Churakov, Andrei V.; Navasardyan, Mger A. Crystal structure of 4-[(3-methylbut-3-enoyl)oxy]phenyl 4-<i>n</i>-hexyloxybenzoate Acta Crystallographica Section E 73(7) (2017) 1052-1055
Space group: P -1
Cell volume: 1008.37
Cell parameters: 5.6805; 8.3846; 21.4864; 99.191; 92.719; 91.701;  

COD ID: 2242228
CIF file

HKL data

Original IUCr paper

Formula: - Ba Cu0.34 S3 Ta0.66 -
Comments: Bu, Kejun; He, Jianqiao; Wang, Dong; Zheng, Chong; Huang, Fuqiang Crystal structure of the mixed-metal trisulfide BaCu~1/3~Ta~2/3~S~3~ Acta Crystallographica Section E 73(5) (2017) 713-715
Space group: P 63/m m c
Cell volume: 235.94
Cell parameters: 6.835; 6.835; 5.8318; 90; 90; 120;  

COD ID: 2242229
CIF file

HKL data

Original IUCr paper

Formula: - C30 H24 Co N6 O2 S2 -
Comments: Suckert, Stefan; Werner, Julia; Jess, Inke; Näther, Christian Crystal structure of bis(acetonitrile-κ<i>N</i>)bis(4-benzoylpyridine-κ<i>N</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II) Acta Crystallographica Section E 73(3) (2017) 365-368
Space group: P 1 21/n 1
Cell volume: 1526.46
Cell parameters: 10.0304; 8.3355; 18.2581; 90; 90.547; 90;  

COD ID: 2242230
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 N2 O4 -
Comments: Forsyth, Craig M.; Francis, Craig L. Crystal structures of two 2,3-diethylnaphtho[2,3-<i>g</i>]quinoxaline-6,11-dione derivatives Acta Crystallographica Section E 73(8) (2017) 1125-1129
Space group: P 4/n
Cell volume: 3392.8
Cell parameters: 28.2529; 28.2529; 4.2504; 90; 90; 90;  

COD ID: 2242231
CIF file

HKL data

Original IUCr paper

Formula: - C30 H34 N4 O2 -
Comments: Forsyth, Craig M.; Francis, Craig L. Crystal structures of two 2,3-diethylnaphtho[2,3-<i>g</i>]quinoxaline-6,11-dione derivatives Acta Crystallographica Section E 73(8) (2017) 1125-1129
Space group: P -1
Cell volume: 2462
Cell parameters: 11.6144; 11.8249; 19.0526; 75.102; 77.31; 83.321;  

COD ID: 2242232
CIF file

HKL data

Original IUCr paper

Formula: - C6 H8 N4 -
Comments: Eya'ane Meva, Francois; Prior, Timothy John; Evans, David John; Mang, Emmanuel Roland Crystal structures of <i>N</i>'-aminopyridine-2-carboximidamide and <i>N</i>'-{[1-(pyridin-2-yl)ethylidene]amino}pyridine-2-carboximidamide Acta Crystallographica Section E 73(7) (2017) 1021-1025
Space group: P 1 21 1
Cell volume: 319.07
Cell parameters: 5.6955; 3.8408; 14.592; 90; 91.631; 90;  

COD ID: 2242233
CIF file

HKL data

Formula: - C13 H13 N5 -
Comments: Eya'ane Meva, Francois; Prior, Timothy John; Evans, David John; Mang, Emmanuel Roland Crystal structures of <i>N</i>'-aminopyridine-2-carboximidamide and <i>N</i>'-{[1-(pyridin-2-yl)ethylidene]amino}pyridine-2-carboximidamide Acta Crystallographica Section E 73(7) (2017) 1021-1025
Space group: P 21 21 21
Cell volume: 1222.8
Cell parameters: 6.6899; 18.93; 9.6561; 90; 90; 90;  

COD ID: 2242234
CIF file

HKL data

Original IUCr paper

Formula: - C15 H15 N O2 -
Comments: AaminaNaaz, Y.; Sathiyaraj, Subramaniyan; Kalaimani, Sundararaj; Nasar, A. Sultan; SubbiahPandi, A. Crystal structure of phenyl <i>N</i>-(3,5-dimethylphenyl)carbamate Acta Crystallographica Section E 73(6) (2017) 849-852
Space group: P -1
Cell volume: 1341.29
Cell parameters: 9.4257; 12.2054; 13.2067; 62.979; 82.329; 87.145;  

COD ID: 2242235
CIF file

HKL data

Original IUCr paper

Formula: - C18 H10 Ca2 Cu O14 -
Comments: Zhang, Feng; Zhang, Bing-Guang Crystal structure of a heterometallic coordination polymer: poly[diaquabis(μ~7~-benzene-1,3,5-tricarboxylato)dicalcium(II)copper(II)] Acta Crystallographica Section E 73(6) (2017) 835-837
Space group: P -1
Cell volume: 471.6
Cell parameters: 6.664; 8.754; 8.925; 103.065; 110.14; 92.776;  

COD ID: 2242236
CIF file

HKL data

Original IUCr paper

Formula: - C19 H16 N2 O2 -
Comments: Peña-Solórzano, Diana; König, Burkhard; Sierra, Cesar A.; Ochoa-Puentes, Cristian Crystal structures of three <i>N</i>-(3-acetylphenyl)quinoline-2-carboxamides Acta Crystallographica Section E 73(6) (2017) 804-808
Space group: P 1 21/c 1
Cell volume: 1514.92
Cell parameters: 4.5787; 14.7986; 22.3732; 90; 92.13; 90;  

COD ID: 2242237
CIF file

HKL data

Original IUCr paper

Formula: - C18 H13 Br N2 O2 -
Comments: Peña-Solórzano, Diana; König, Burkhard; Sierra, Cesar A.; Ochoa-Puentes, Cristian Crystal structures of three <i>N</i>-(3-acetylphenyl)quinoline-2-carboxamides Acta Crystallographica Section E 73(6) (2017) 804-808
Space group: P -1
Cell volume: 746.76
Cell parameters: 4.29848; 11.6353; 15.5888; 103.788; 95.515; 96.195;  

COD ID: 2242238
CIF file

HKL data

Original IUCr paper

Formula: - C20 H14 N2 O2 -
Comments: Peña-Solórzano, Diana; König, Burkhard; Sierra, Cesar A.; Ochoa-Puentes, Cristian Crystal structures of three <i>N</i>-(3-acetylphenyl)quinoline-2-carboxamides Acta Crystallographica Section E 73(6) (2017) 804-808
Space group: P -1
Cell volume: 770.11
Cell parameters: 7.3075; 8.2605; 13.8196; 92.734; 100.608; 108.989;  

COD ID: 2242239
CIF file

HKL data

Original IUCr paper

Formula: - C30 H36 B2 Cu F8 N6 -
Comments: Chen, Lin; Guo, Yakun; Ren, Gan; Sang, Ge Crystal structure of [Cu(tmpen)](BF~4~)~2~ {tmpen is <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis[(6-methylpyridin-2-yl)methyl]ethane-1,2-diamine} Acta Crystallographica Section E 73(4) (2017) 640-643
Space group: C 1 2/c 1
Cell volume: 3207.2
Cell parameters: 18.67; 12.8309; 14.0146; 90; 107.193; 90;  

COD ID: 2242240
CIF file

HKL data

Original IUCr paper

Formula: - C19 H13 Cl O3 Se -
Comments: Zukerman-Schpector, Julio; Prado, Karinne E.; Name, Luccas L.; Cella, Rodrigo; Jotani, Mukesh M.; Tiekink, Edward R. T. 2-[(4-Chlorophenyl)selanyl]-3,4-dihydro-2<i>H</i>-benzo[<i>h</i>]chromene-5,6-dione: crystal structure and Hirshfeld analysis Acta Crystallographica Section E 73(6) (2017) 918-924
Space group: P 1 21/c 1
Cell volume: 1640.35
Cell parameters: 7.3757; 13.7306; 16.4473; 90; 100.002; 90;  

COD ID: 2242241
CIF file

HKL data

Original IUCr paper

Formula: - Al0.75 As2 Cr0.25 K O7 -
Comments: Bouhassine, Mohamad Alem; Boughzala, Habib New mixed aluminium‒chromium diarsenate Acta Crystallographica Section E 73(3) (2017) 345-348
Space group: P -1
Cell volume: 299.8
Cell parameters: 6.243; 6.349; 8.153; 96.57; 104.45; 103.08;  

COD ID: 2242242
CIF file

HKL data

Original IUCr paper

Formula: - C20 H14 Cl N3 Ni O -
Comments: Kobayashi, Fumiya; Koga, Atsushi; Ohtani, Ryo; Hayami, Shinya; Nakamura, Masaaki Crystal structure of [2-({2-[(2-azanidylbenzylidene)amino]benzylidene}amino)-4-chlorophenolato]nickel(II) Acta Crystallographica Section E 73(4) (2017) 637-639
Space group: P 1 21/c 1
Cell volume: 1608.65
Cell parameters: 7.551; 17.8689; 12.6834; 90; 109.95; 90;  

COD ID: 2242243
CIF file

HKL data

Formula: - C8 H19 N O7 -
Comments: Publicover, Ernlie A.; Kolwich, Jennifer; Stack, Darcie L.; Doué, Alyssa J.; Ylijoki, Kai E. O. Crystal structure of (<i>S</i>)-<i>sec</i>-butylammonium <small>L</small>-tartrate monohydrate Acta Crystallographica Section E 73(5) (2017) 716-719
Space group: P 21 21 2
Cell volume: 1190.13
Cell parameters: 11.0921; 14.8876; 7.207; 90; 90; 90;  

COD ID: 2242244
CIF file

HKL data

Original IUCr paper

Formula: - C23 H18 F N O4 -
Comments: Lehmann, Anna; Lechner, Lisa; Radacki, Krzysztof; Braunschweig, Holger; Holzgrabe, Ulrike Crystal structure of (3<i>S</i>*,4<i>R</i>*)-4-fluoro-3-(4-methoxyphenyl)-1-oxo-2-phenyl-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid Acta Crystallographica Section E 73(6) (2017) 867-870
Space group: P 1 21/c 1
Cell volume: 1806.1
Cell parameters: 8.4849; 15.407; 14.157; 90; 102.598; 90;  

COD ID: 2242245
CIF file

HKL data

Original IUCr paper

Formula: - Cr O7 Pb2 Te -
Comments: Weil, Matthias Crystal structure of dilead(II) oxochromate(VI) oxotellurate(IV) Acta Crystallographica Section E 73(6) (2017) 853-855
Space group: P 1 21/n 1
Cell volume: 708.9
Cell parameters: 7.4736; 10.8091; 9.4065; 90; 111.098; 90;  

COD ID: 2242246
CIF file

HKL data

Original IUCr paper

Formula: - C18 H36 Co N10 O12 S2 -
Comments: El Hamdani, H.; El Amane, M.; Duhayon, C. Crystal structure of the tetraaquabis(thiocyanato-κ<i>N</i>)cobalt(II)‒caffeine‒water (1/2/4) co-crystal Acta Crystallographica Section E 73(7) (2017) 980-982
Space group: P 1 21/c 1
Cell volume: 1561.93
Cell parameters: 10.65854; 8.16642; 18.0595; 90; 96.4701; 90;  

COD ID: 2242247
CIF file

Original IUCr paper

Formula: - C24 H13 Br O6 -
Comments: Tonin, Marlon D. L.; Garden, Simon J.; Jotani, Mukesh M.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. The 1:1 co-crystal of 2-bromonaphthalene-1,4-dione and 1,8-dihydroxyanthracene-9,10-dione: crystal structure and Hirshfeld surface analysis Acta Crystallographica Section E 73(5) (2017) 738-745
Space group: P 1 21/c 1
Cell volume: 1864.9
Cell parameters: 17.5509; 4.85939; 22.83423; 90; 106.743; 90;  

COD ID: 2242248
CIF file

HKL data

Original IUCr paper

Formula: - C14 H17 N5 O S -
Comments: Choudhury, Manisha; Viswanathan, Vijayan; Timiri, Ajay Kumar; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Velmurugan, Devadasan Crystal structures of 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(2,4-dimethylphenyl)acetamide and 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(3-methoxyphenyl)acetamide Acta Crystallographica Section E 73(7) (2017) 996-1000
Space group: P 1 21/c 1
Cell volume: 1514.31
Cell parameters: 23.7716; 7.0073; 9.0909; 90; 90.086; 90;  

COD ID: 2242249
CIF file

HKL data

Original IUCr paper

Formula: - C13 H15 N5 O2 S -
Comments: Choudhury, Manisha; Viswanathan, Vijayan; Timiri, Ajay Kumar; Sinha, Barij Nayan; Jayaprakash, Venkatesan; Velmurugan, Devadasan Crystal structures of 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(2,4-dimethylphenyl)acetamide and 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(3-methoxyphenyl)acetamide Acta Crystallographica Section E 73(7) (2017) 996-1000
Space group: P -1
Cell volume: 730.9
Cell parameters: 8.014; 8.724; 12.068; 106.561; 97.888; 110.461;  

COD ID: 2242250
CIF file

HKL data

Original IUCr paper

Formula: - C22 H34 O6 -
Comments: Piccialli, Vincenzo; Tuzi, Angela; Centore, Roberto Crystal structure of a new spiro-polytetrahydrofuran compound with translational pseudosymmetry: <i>rac</i>-(2<i>S</i>,2'<i>S</i>,5'<i>R</i>)-2-methyl-5'-[(1<i>R</i>,2<i>R</i>,5<i>S</i>,5'<i>R</i>)-1,4,4,5'-tetramethyldihydro-3'<i>H</i>-3,8-dioxaspiro[bicyclo[3.2.1]octane-2,2'-furan]-5'-yl]hexahydro[2,2'-bifuran]-5(2<i>H</i>)-one Acta Crystallographica Section E 73(5) (2017) 780-784
Space group: P -1
Cell volume: 2043
Cell parameters: 11.75; 13.805; 14.737; 68.622; 67.78; 88.557;  

COD ID: 2242251
CIF file

HKL data

Original IUCr paper

Formula: - C16 H13 N3 O S -
Comments: Simpson, Jim; Mohamed, Shaaban K.; El-Emary, Talaat I.; Albayati, Mustafa R. Crystal structure of 5-[2-(9<i>H</i>-carbazol-9-yl)ethyl]-1,3,4-oxadiazole-2(3<i>H</i>)-thione Acta Crystallographica Section E 73(7) (2017) 1066-1069
Space group: P 1 21/c 1
Cell volume: 1371.87
Cell parameters: 16.6868; 4.96; 17.2353; 90; 105.909; 90;  

COD ID: 2242252
CIF file

HKL data

Original IUCr paper

Formula: - C17 H18 N2 O -
Comments: Rivera, Augusto; Miranda-Carvajal, Ingrid; Ríos-Motta, Jaime; Bolte, Michael Crystal structure of 1,3-bis[(<i>E</i>)-benzylideneamino]propan-2-ol Acta Crystallographica Section E 73(4) (2017) 627-629
Space group: P b c a
Cell volume: 2922.5
Cell parameters: 16.4313; 7.1909; 24.7345; 90; 90; 90;  

COD ID: 2242253
CIF file

HKL data

Original IUCr paper

Formula: - C29 H34 F N5 S -
Comments: Al-Alshaikh, Monirah A.; Al-Mutairi, Aamal A.; Ghabbour, Hazem A.; El-Emam, Ali A.; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago Syntheses and crystal structures of two adamantyl-substituted 1,2,4-triazole-5-thione <i>N</i>-Mannich bases Acta Crystallographica Section E 73(8) (2017) 1135-1139
Space group: P -1
Cell volume: 1305.66
Cell parameters: 10.4173; 10.9849; 12.0002; 72.769; 84.623; 89.244;  

COD ID: 2242254
CIF file

HKL data

Original IUCr paper

Formula: - C30 H36 F N5 O S -
Comments: Al-Alshaikh, Monirah A.; Al-Mutairi, Aamal A.; Ghabbour, Hazem A.; El-Emam, Ali A.; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago Syntheses and crystal structures of two adamantyl-substituted 1,2,4-triazole-5-thione <i>N</i>-Mannich bases Acta Crystallographica Section E 73(8) (2017) 1135-1139
Space group: P 1 21/c 1
Cell volume: 2762.9
Cell parameters: 11.3074; 12.1576; 20.4976; 90; 101.328; 90;  

COD ID: 2242255
CIF file

HKL data

Original IUCr paper

Formula: - C14 H8 Cl N O2 -
Comments: Wang, Bing; Lu, Qing; Fang, Qi; Zhang, Ting-ting; Jin, Ying-ying 6-Chloro-1-phenylindoline-2,3-dione: absolute structure, non-linear optical and charge-transport properties Acta Crystallographica Section E 73(6) (2017) 908-912
Space group: P 21 21 21
Cell volume: 1142.89
Cell parameters: 6.819; 7.7062; 21.7492; 90; 90; 90;  

COD ID: 2242256
CIF file

HKL data

Original IUCr paper

Formula: - Na O4 Tc -
Comments: German, Konstantin E.; Grigoriev, Mikhail S.; Garashchenko, Bogdan L.; Kopytin, Alexander V.; Tyupina, Ekaterina A. Redetermination of the crystal structure of NaTcO~4~ at 100 and 296K based on single-crystal X-ray data Acta Crystallographica Section E 73(7) (2017) 1037-1040
Space group: I 41/a
Cell volume: 329.29
Cell parameters: 5.2945; 5.2945; 11.747; 90; 90; 90;  

COD ID: 2242257
CIF file

HKL data

Original IUCr paper

Formula: - Na O4 Tc -
Comments: German, Konstantin E.; Grigoriev, Mikhail S.; Garashchenko, Bogdan L.; Kopytin, Alexander V.; Tyupina, Ekaterina A. Redetermination of the crystal structure of NaTcO~4~ at 100 and 296K based on single-crystal X-ray data Acta Crystallographica Section E 73(7) (2017) 1037-1040
Space group: I 41/a :2
Cell volume: 336.97
Cell parameters: 5.3325; 5.3325; 11.8503; 90; 90; 90;  

COD ID: 2242258
CIF file

HKL data

Original IUCr paper

Formula: - C20 H18 Co N6 O8 S -
Comments: Li, Guo-Ling; Sato, Osamu A compressed octahedral cobalt(II) complex in the crystal structure of diaqua[6,6'-sulfanediylbis(2,2'-bipyridine)]cobalt(II) dinitrate Acta Crystallographica Section E 73(7) (2017) 993-995
Space group: P 1 21/c 1
Cell volume: 2215.4
Cell parameters: 13.412; 11.421; 15.441; 90; 110.5; 90;  

COD ID: 2242259
CIF file

HKL data

Original IUCr paper

Formula: - C18 H26 O4 -
Comments: Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim Crystal structures of the polymer precursors 3-(2,5-dimethoxy-3,4,6-trimethylphenyl)propyl methacrylate and 3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dienyl)propyl methacrylate Acta Crystallographica Section E 73(5) (2017) 658-663
Space group: P 1 21/n 1
Cell volume: 1656.4
Cell parameters: 5.1833; 30.341; 10.6339; 90; 97.91; 90;  

COD ID: 2242260
CIF file

HKL data

Original IUCr paper

Formula: - C16 H20 O4 -
Comments: Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim Crystal structures of the polymer precursors 3-(2,5-dimethoxy-3,4,6-trimethylphenyl)propyl methacrylate and 3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dienyl)propyl methacrylate Acta Crystallographica Section E 73(5) (2017) 658-663
Space group: P 1 21/n 1
Cell volume: 1472.55
Cell parameters: 4.4096; 11.8425; 28.2511; 90; 93.495; 90;  

COD ID: 2242261
CIF file

HKL data

Original IUCr paper

Formula: - C4 H8 N2 O2 -
Comments: Frampton, Christopher S.; Murray, James I.; Spivey, Alan C. Crystal structure of 1-methylimidazole 3-oxide monohydrate Acta Crystallographica Section E 73(3) (2017) 372-374
Space group: P 1 21 1
Cell volume: 553.51
Cell parameters: 7.5941; 10.0703; 7.8286; 90; 112.402; 90;  

COD ID: 2242262
CIF file

HKL data

Original IUCr paper

Formula: - C28 H26 Co N4 O4 S2 -
Comments: Suckert, Stefan; Werner, Julia; Jess, Inke; Näther, Christian Crystal structure of bis(4-benzoylpyridine-κ<i>N</i>)bis(methanol-κ<i>O</i>)bis(thiocyanato-κ<i>N</i>)cobalt(II) Acta Crystallographica Section E 73(4) (2017) 616-619
Space group: P 1 21/n 1
Cell volume: 1404.22
Cell parameters: 12.0367; 7.2497; 16.1396; 90; 94.404; 90;  

COD ID: 2242263
CIF file

HKL data

Formula: - C18 H10 Cl N O -
Comments: Bao, Lipiao; Olmstead, Marilyn M. A temperature-dependent phase transformation of (<i>E</i>)-2-[(4-chlorophenyl)imino]acenaphthylen-1-one Acta Crystallographica Section E 73(8) (2017) 1255-1258
Space group: P 1 21/m 1
Cell volume: 677.15
Cell parameters: 9.0447; 6.8764; 10.9021; 90; 92.959; 90;  


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