Crystallography Open Database

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1557175 CIF
HKL
Paper
C16 H21 N3 O4P -18.127; 8.411; 12.536
105.36; 96.52; 94.77
815.2Yoo, Miri; Koh, Dongsoo
Diethyl 4-(1<i>H</i>-imidazol-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
IUCrData, 2020, 5, x200034
1557176 CIF
HKL
Paper
C25 H22 N2 O2 SeP 1 21/c 113.209; 6.343; 27.08
90; 103.356; 90
2207.5Morris, LaQuze L.; Alvarado, Clarisa A.; Goncalves, Julia M.; Singh, Ravi P.; Lovely, Carl J.; Yousufuddin, Muhammed
[4-(4-Methoxyphenyl)-8-oxo-3-(phenylselanyl)spiro[4.5]deca-3,6,9-trien-2-yl]methylcyanamide
IUCrData, 2020, 5, x200078
1557177 CIF
HKL
Paper
C40 H74 Co N8 S4P -17.484; 8.587; 18.523
83.782; 81.868; 71.189
1113Giltzau, Niels Ole; Köckerling, Martin
Bis(1-dodecyl-4-aza-1-azoniabicyclo[2.2.2]octane)tetraisothiocyanatocobalt(II)
IUCrData, 2020, 5, x200023
1557178 CIF
HKL
Paper
C18 H17 F O5P 1 21/c 115.5801; 8.3414; 12.1298
90; 97.086; 90
1564.35Yoo, Miri; Koh, Dongsoo
(<i>E</i>)-1-(4-Fluoro-2-hydroxyphenyl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one
IUCrData, 2020, 5, x200071
1557208 CIF
HKL
Paper
C20 H24 N2 O6 S2C 1 2/c 129.1537; 8.8739; 19.9919
90; 123.621; 90
4306.9Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
Benzene-1,2-diaminium bis(4-methylbenzene-1-sulfonate)
IUCrData, 2020, 5, x200100
1557209 CIF
HKL
Paper
Br Cs F4I m m m5.5075; 6.789; 12.2572
90; 90; 90
458.3Malin, Artem V.; Ivlev, Sergei I.; Ostvald, Roman V.; Kraus, Florian
Redetermination of the crystal structure of caesium tetrafluoridobromate(III) from single-crystal X-ray diffraction data
IUCrData, 2020, 5, x200114
1557210 CIF
HKL
Paper
C19 H13 I O2P 1 21/n 17.0481; 18.2185; 12.6391
90; 104.947; 90
1568.02Dean, Raven; Miller, Chelsea N.; Zingales, Sarah K.; Padgett, Clifford W.
3-(4-Iodophenyl)-2,3-dihydro-1<i>H</i>-benzo[<i>f</i>]chromen-1-one
IUCrData, 2020, 5, x200110
1557252 CIF
HKL
Paper
C29 H23 Cl N2 OP 1 21/n 19.0627; 10.7595; 24.4636
90; 100.599; 90
2344.7Shraddha, K. N.; Devika, S.; Begum, Noor Shahina
4-Chloro-2-[1-(4-ethylphenyl)-4,5-diphenyl-1<i>H</i>-imidazol-2-yl]phenol
IUCrData, 2020, 5, x191690
1557264 CIF
HKL
Paper
C14 H27 F6 N O11 S2P 1 21 18.8341; 24.3932; 11.6111
90; 108.086; 90
2378.47Kitada, Atsushi; Funasako, Yusuke; Matsumoto, Kazuhiko; Hagiwara, Rika; Inokuchi, Makoto; Fukami, Kazuhiro; Murase, Kuniaki
Hydronium bis(trifluoromethanesulfonyl)amide‒18-crown-6 (1/1)
IUCrData, 2020, 5, x200162
1557302 CIF
HKL
Paper
C20 H18 N4 O2P b c a8.7438; 18.7561; 20.8005
90; 90; 90
3411.27Powell, Gregory L.; Rix, Brad A.
5-Methyl-4-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one
IUCrData, 2020, 5, x200121
1557303 CIF
HKL
Paper
C5 H20 Cs2 Mg4 O25P 1 21/n 19.1617; 19.233; 13.0065
90; 91.136; 90
2291.4Rincke, Christine; Schmidt, Horst; Voigt, Wolfgang
Dicaesium tetramagnesium pentakis(carbonate) decahydrate, Cs2Mg4(CO3)5·10H2O
IUCrData, 2020, 5
1557304 CIF
HKL
Paper
C11 H10 N2 O2 S2P 1 21 14.1658; 10.4706; 12.7624
90; 95.958; 90
553.67Siegel, David J.; Howarth, Alexis N.; Traver, Joseph R.; Hillesheim, Patrick C.; Zeller, Matthias; Mirjafari, Arsalan
2,2'-[Methylenebis(sulfanediyl)]bis(pyridine 1-oxide)
IUCrData, 2020, 5, x200171
1557305 CIF
HKL
Paper
C21 H20 Br N O4 SP 4111.076; 11.076; 16.478
90; 90; 90
2021.5Soundararajan, Krishnan; Sethuraman, Velusamy; Thanigaimani, Kaliyaperumal
(3<i>S</i>,5<i>R</i>,6<i>S</i>)-Diphenylmethyl 1-oxo-6-bromopenicillanate
IUCrData, 2020, 5, x200143
1557306 CIF
HKL
Paper
C21 H39 N S2P 1 21 15.5457; 9.1108; 43.511
90; 90.376; 90
2198.4Muller II, Joseph E.; Osborn, Laura R.; Traver, Joseph R.; Hillesheim, Patrick C.; Zeller, Matthias; Mirjafari, Arsalan
2-(Octadecylsulfanyl)-1,3-thiazole
IUCrData, 2020, 5, x200170
1557320 CIF
Paper
C16 H9 N3 O2 S2P 1 21 19.6598; 7.4249; 11.2457
90; 109.745; 90
759.15de Freitas, Jorge F.; Brown, Shayne; Oberndorfer, James S.; Crundwell, Guy
5-Nitro-2,3-bis(thiophen-2-yl)quinoxaline
IUCrData, 2020, 5, x200196
1557321 CIF
HKL
Paper
C16 H9 N3 O2 S2P 1 21/c 111.7649; 5.3386; 24.3536
90; 105.61; 90
1473.18de Freitas, Jorge F.; Brown, Shayne; Oberndorfer, James S.; Crundwell, Guy
6-Nitro-2,3-bis(thiophen-2-yl)quinoxaline
IUCrData, 2020, 5, x200203
1557368 CIF
HKL
Paper
C24 H20 O2P 1 21/n 121.55; 6.0366; 27.4915
90; 92.111; 90
3573.9Manickam, R.; Jagadeesan, G.; Karunakaran, J.; Srinivasan, G.
1,4-Bis(4-methoxyphenyl)naphthalene
IUCrData, 2020, 5, x200212
1557369 CIF
HKL
Paper
C13 H16 N2 O3 SP 1 21/n 114.6392; 5.7111; 17.5295
90; 102.349; 90
1431.66Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
2-Aminoanilinium 4-methylbenzenesulfonate
IUCrData, 2020, 5, x200230
1557370 CIF
HKL
Paper
C26 H34 O4 Si2P 1 21/c 110.2628; 20.5653; 13.3923
90; 111.638; 90
2627.4Weil, Matthias; Kremsmayr, Thomas; Mihovilovic, Marko D.
6-[(<i>tert</i>-Butyldimethylsilyl)oxy]-3-ethenyl-7-methoxy-4-[(trimethylsilyl)ethynyl]naphtho[2,3-<i>c</i>]furan-1(3<i>H</i>)-one
IUCrData, 2020, 5, x200224
1557413 CIF
HKL
Paper
C11 H14 N2 O4P 1 21/c 113.949; 4.9891; 17.3647
90; 105.693; 90
1163.42Doboszewski, Bogdan; Nazarenko, Alexander Y.; Soares, Fábio da Paixão
1,3-Bis(2-oxopropyl)thymine
IUCrData, 2020, 5, x200257
1557414 CIF
HKL
Paper
C25 H19 N O7P 1 21/c 114.7455; 11.9504; 11.9649
90; 101.898; 90
2063.1Lough, Alan J.; Ho, Angel; Tam, William
[(1<i>R</i>*,3<i>S</i>*,4<i>S</i>*)-3-(2-Hydroxybenzoyl)-1,2,3,4-tetrahydro-1,4-epoxynaphthalen-1-yl]methyl 4-nitrobenzoate
IUCrData, 2020, 5, x200265
1557436 CIF
HKL
Paper
C30 H46 Br4 Mn N4P b c a18.02; 18.742; 19.74
90; 90; 90
6666.8Giltzau, Niels Ole; Köckerling, Martin
Bis(N-adamantyl-N′-ethylimidazolium) tetrabromidomanganate(II)
IUCrData, 2020, 5
1557516 CIF
HKL
Paper
C14 H14 OP 1 21/c 19.4559; 12.8405; 8.9638
90; 111.445; 90
1013.02Lough, Alan J.; Pounder, Austin; Wicks, Christopher; Tam, William
1,2,3,5-Tetrahydronaphtho[2,1-<i>c</i>]oxepine
IUCrData, 2020, 5, x200288
1557517 CIF
HKL
Paper
C32 H24P 1 21/c 19.3106; 8.7232; 13.4776
90; 91.959; 90
1093.99Detert, Heiner; Jacobs, Nina; Schollmeyer, Dieter
The head-to-head photodimer of indenoindene
IUCrData, 2020, 5, x200307
1557518 CIF
HKL
Paper
C19 H16 OP b c a9.4802; 14.9824; 18.6565
90; 90; 90
2649.9Lough, Alan J.; Pounder, Austin; Tam, William
12-Ethyl-6a,10a-dihydro-5<i>H</i>-6-oxachrysene
IUCrData, 2020, 5, x200286
1557519 CIF
HKL
Paper
C27 H33 N7 O3P m n 2116.7781; 16.3902; 4.7894
90; 90; 90
1317.1Anzaldo-Olivares, Bertin; Arroyo, Maribel; Ramírez-Monroy, Armando; Bernès, Sylvain
Tris(1<i>H</i>-benzimidazol-2-ylmethyl)amine methanol trisolvate
IUCrData, 2020, 5, x200281
1557573 CIF
HKL
Paper
C19 H18 O2P 1 21/c 112.2712; 11.2934; 10.8984
90; 112.565; 90
1394.71Lough, Alan J.; Koh, Samuel; Tam, William
12,15-Dimethyl-8-oxatetracyclo[8.8.0.0^2,7^.0^11,16^]octadeca-1(18),2,4,6,11(16),12,14-heptaen-10-ol
IUCrData, 2020, 5, x200315
1557611 CIF
HKL
Paper
C59 H90 N9 O10 SP 21 21 219.942; 22.986; 26.512
90; 90; 90
6059Purdy, Sarah Kendra; Spasyuk, Denis; Chitanda, Jackson Mulenga; Reaney, Martin J. T.
[1‒9-NαC]-Linusorb B3 (Cyclolinopeptide A) dimethyl sulfoxide monosolvate
IUCrData, 2020, 5, x200318
1557612 CIF
HKL
Paper
C17 H14 N2 O SC 1 c 19.434; 17.134; 8.826
90; 105.01; 90
1378Tojiboev, Akmal; Nasrullaev, Azizbek; Turgunov, Kambarali; Elmuradov, Burkhan; Tashkhodjaev, Bakhodir
(<i>E</i>)-6-(Furan-2-ylmethylidene)-6,7,8,9-tetrahydropyrido[2,1-<i>b</i>]quinazoline-11-thione
IUCrData, 2020, 5
1557619 CIF
HKL
Paper
C14 H11 Cl N2 O2 SP -17.2285; 7.2385; 13.7586
102.192; 99.616; 104.149
663.91Narayan, Easha; Fu, Liangfeng; Gribble, Gordon W.; Kaur, Manpreet; Jasinski, Jerry P.
7-Chloro-3-(4-methylphenylsulfonyl)pyrrolo[1,2-<i>c</i>]pyrimidine
IUCrData, 2020, 5
1557620 CIF
HKL
Paper
C30 H22 N4P 1 21/c 17.0953; 8.931; 18.219
90; 95.49; 90
1149.2Detert, Heiner; Jochem, Matthias; Schollmeyer, Dieter
2,5-Bis[(<i>E</i>)-2-phenylethenyl]-3,6-bis(pyridin-2-yl)pyrazine
IUCrData, 2020, 5
1557683 CIF
HKL
Paper
C10 H13 N5P 1 21/c 110.7335; 12.4005; 7.9206
90; 93.654; 90
1052.09Bhat, Radhika; Shraddha, K. N.; Begum, Noor Shahina
4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbonitrile
IUCrData, 2020, 5
1557697 CIF
HKL
Paper
C26 H22 O6P 1 21/c 16.1631; 19.253; 18.0743
90; 96.83; 90
2129.4Lesley, Melvin J. G.; Ozhan, Koray; Sung, Herman H.-Y.; Williams, Ian D.
Trimethyl 4,4',4''-(ethene-1,1,2-triyl)tribenzoate
IUCrData, 2020, 5, x200417
1557751 CIF
HKL
Paper
C66 H94 N7 O18 V7P 1 21/c 114.6285; 29.9816; 20.5191
90; 94.548; 90
8971Kodama, Shintaro; Kondo, Shota; Nomoto, Akihiro; Ogawa, Akiya
Tris(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine)(<i>trans</i>-4-<i>tert</i>-butylcyclohexanolato)deca-μ-oxido-heptaoxidoheptavanadium acetonitrile monosolvate including another unknown solvent molecule
IUCrData, 2020, 5, x200449
1557752 CIF
HKL
C12 H16 Cu2 I2 N2 S4P 1 21/c 18.7612; 13.1852; 16.4458
90; 94.4; 90
1894.2Assoumatine, Tokouré; Stoeckli-Evans, Helen
Poly[[μ~4~-3,4,8,10,11,13-hexahydro-1<i>H</i>,6<i>H</i>-bis([1,4]dithiocino)[6,7-<i>b</i>:6',7'-<i>e</i>]pyrazine]di-μ-iodido-dicopper(I)]: a two-dimensional copper(I) coordination polymer
IUCrData, 2020, 5, x200467
1557753 CIF
HKL
Paper
C6 H6 F8 O4P 1 21 15.3009; 8.625; 10.6976
90; 91.146; 90
489Feightner, Kylie; Powell, Douglas R.; Burba, Christopher M.
2,2,3,3,4,4,5,5-Octafluorohexane-1,6-diol
IUCrData, 2020, 5, x200445
1557817 CIF
HKL
Paper
C17 H22 N2 OP 1 21/n 16.1444; 12.8514; 19.3315
90; 91.626; 90
1525.9Chadeayne, Andrew R.; Pham, Duyen N. K.; Golen, James A.; Manke, David R.
5-MeO-DALT: the freebase of N,N-diallyl-5-methoxytryptamine
IUCrData, 2020, 5
1557847 CIF
HKL
Paper
C20 H21 N OC 1 2/c 116.7588; 23.4597; 8.7769
90; 98.771; 90
3410.34Manjula, V.; Venkateswaramoorthi, R.; Dharmaraja, J.; Selvanayagam, S.
2,6-Diphenyl-3-(prop-2-en-1-yl)piperidin-4-one
IUCrData, 2020, 5, x200526
1557980 CIF
HKL
Paper
C16 H16 N2I -413.93535; 13.93535; 13.1629
90; 90; 90
2556.16Crundwell, Guy; Leeds, Ashley
2,3-Diethylbenzo[<i>g</i>]quinoxaline
IUCrData, 2020, 5, x200454
1557981 CIFC52 H40 N2P -16.383; 12.498; 12.814
68.718; 86.988; 81.397
942Zhang, Yang; Yu, Fan; Li, Pei; Xu, Mengli; Xu, Guoyong; Li, Weimin; Wang, Fuzhou
2,4,6-Triphenyl-<i>N</i>-{(3<i>E</i>)-3-[(2,4,6-triphenylphenyl)imino]butan-2-ylidene}aniline
IUCrData, 2020, 5, x200531
1558035 CIF
HKL
Paper
C11 H11 N O5P -14.8774; 9.47; 12.719
106.784; 97.222; 92.444
556.1Yu, MingChao; Wang, LinLin; Wang, LingYang; Wu, ZhiYong
2-(2-Ethoxy-2-oxoacetamido)benzoic acid
IUCrData, 2020, 5, x200603
1558091 CIF
HKL
Paper
C5 H9 Cl N2P 21 21 216.3076; 9.549; 11.3951
90; 90; 90
686.34Anderson, Grace; Mirjafari, Arsalan; Zeller, Matthias; Hillesheim, Patrick C.
2,3-Dimethyl-1<i>H</i>-imidazol-3-ium chloride
IUCrData, 2020, 5, x200660
1558159 CIF
HKL
Paper
C25 H18 Cl F2 N5 SP 1 21/c 116.9376; 13.144; 10.6399
90; 92.891; 90
2365.72Alanazi, Saud A.; Abdel-Wahab, Bakr F.; Hegazy, Amany S.; Kariuki, Benson M.; El-Hiti, Gamal A.
2-[3-(4-Chlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-5-[(4-fluorophenyl)diazenyl]-4-methylthiazole
IUCrData, 2020, 5, x200700
1558160 CIF
HKL
Paper
C16 H22 N4 O3 SP 1 21/n 110.882; 8.4029; 18.9678
90; 95.44; 90
1726.61Cyr, Noah; Zeller, Matthias; Hillesheim, Patrick C.; Mirjafari, Arsalan
2,3-Dimethyl-1<i>H</i>-imidazol-3-ium benzenesulfonate‒1,2-dimethyl-1<i>H</i>-imidazole co-crystal
IUCrData, 2020, 5, x200689
1558161 CIF
Paper
C12 H22 N2 O3 SP 1 n 110.2564; 6.5369; 10.9683
90; 95.067; 90
732.5Sarr, Bougar; Mbaye, Abdou; Touré, Assane; Diop, Cheikh Abdoul Khadir; Sidibé, Mamadou; Michaud, François
Dipropylammonium 4-aminobenzenesulfonate
IUCrData, 2020, 5, x200659
1558281 CIF
HKL
Paper
C11 H13 Br N2P b c a10.907; 18.8993; 21.6608
90; 90; 90
4465Peppel, Tim; Wulf, Christoph; Spannenberg, Anke
1-Benzyl-3-methylimidazolium bromide
IUCrData, 2020, 5
1558316 CIF
HKL
Paper
C18 H16 O3P 1 21/c 17.7611; 7.2894; 24.0331
90; 93.5573; 90
1357.02Encarnacion-Thomas, Elvia; Sommer, Roger D.; Mallia, Ajay; Sloop, Joseph
(<i>E</i>)-2-(3,5-Dimethoxybenzylidene)indan-1-one
IUCrData, 2020, 5, x200759
1558329 CIF
HKL
Paper
C23 H34 Cl3 N O12P 15.5734; 9.2537; 14.2547
91.995; 99.103; 95.567
721.56Amaro Hernández, Aldo Guillermo; Rodríguez Tzompantzi, Tomasa; Dávila García, Álvaro; Meza-León, Rosa Luisa; Bernès, Sylvain
Ethyl (3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-3-{(3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-5-oxoisoxazolidin-2-yl}propanoate chloroform monosolvate
IUCrData, 2020, 5, x200788
1558330 CIF
HKL
Paper
C28 H28 O6P 1 21/c 19.9641; 10.2338; 23.541
90; 100.086; 90
2363.4Yoo, Miri; Koh, Dongsoo
(<i>E</i>)-3-{4,6-Dimethoxy-2-[(<i>E</i>)-4-methoxystyryl]-3-methylphenyl}-1-(2-hydroxy-5-methoxyphenyl)prop-2-en-1-one
IUCrData, 2020, 5, x200792
1558379 CIF
HKL
Paper
C48 H40 Co2 N8 O20P -17.2747; 10.4927; 16.356
97.735; 102.84; 102.607
1165.71Srinivasan, Bikshandarkoil R.; Harmalkar, Sarvesh S.; D'Souza, Luann R.; Dhuri, Sunder N.
Di-μ-aqua-bis[aqua(2,2′-bipyridine)(4-nitrobenzoato)cobalt(II)] bis(4-nitrobenzoate)
IUCrData, 2020, 5
1558437 CIF
HKL
Paper
C17 H13 N OP -15.8686; 7.4955; 15.2792
102.195; 90.649; 90.454
656.86Arunkumar, Dandavathi; Samshuddin, Seranthimata; Ansar, Mhammed; Mague, Joel T.; Ramli, Youssef
4-[(<i>E</i>)-3-(4-Methylphenyl)-3-oxoprop-1-en-1-yl]benzonitrile
IUCrData, 2020, 5, x200800
1558456 CIF
HKL
Paper
C30 H39 B I3 N2P 1 21/c 116.01; 12.5361; 16.3086
90; 90.041; 90
3273.2Schödel, Frauke; Lerner, Hans-Wolfram; Bolte, Michael
[1,3-Bis(2,6-diisopropylphenyl)-1,3-dihydro-2<i>H</i>-imidazol-2-ylidene]triiodoborane benzene hemisolvate
IUCrData, 2020, 5, x200863
1558561 CIF
HKL
C56 H20 F20 N4 ZnC 1 2/c 134.176; 6.3699; 26.382
90; 123.428; 90
4793.2Lin, Zeyuan; Li, Jianfeng
[5,10,15,20-Tetrakis(pentafluorophenyl)porphyrinato]zinc(II) benzene disolvate
IUCrData, 2020, 5, x200877
1558562 CIF
Paper
C16 H14 F N O3P 1 21 19.74134; 9.83313; 14.91737
90; 98.2662; 90
1414.06Lee, Kathleen S.; Turner, Luke; Powell, Cynthia B.; Reinheimer, Eric W.
(<i>S</i>)-2-[(4-Fluorophenyl)formamido]-3-phenylpropanoic acid
IUCrData, 2020, 5, x200897
1558563 CIF
HKL
Paper
C29 H25 F N2 O4P 1 21/n 18.996; 15.921; 18.297
90; 102.59; 90
2557.6Jiang, Hong; Li, Yu-Long; Zhou, Jin; Sun, Hong-Shun; Zhang, Qing-Yu; Shi, Xing-Hao; Zhang, Zhi-Yuan; Ling, Tian
Diethyl 3,3'-[(3-fluorophenyl)methylene]bis(1<i>H</i>-indole-2-carboxylate)
IUCrData, 2020, 5, x200912
1558564 CIF
HKL
Paper
C12 H13 N O2P 1 21 15.7173; 7.346; 12.436
90; 93.07; 90
521.6Linkova, Elena I.; Grinev, Vyacheslav S.; Mayorova, Oksana A.; Yegorova, Alevtina Yu.
7a-Phenyltetrahydropyrrolo[2,1-<i>b</i>]oxazol-5(6<i>H</i>)-one
IUCrData, 2020, 5, x200919
1558565 CIF
HKL
Paper
C22 H15 N3 O2P 21 21 217.2994; 9.6105; 23.9296
90; 90; 90
1678.68Devika, S.; Begum, Noor Shahina; Manjappa, Kiran B.; Yang, Ding-Yah
(2-Hydroxyphenyl)(4,2':4',4''-terpyridin-6'-yl)methanone
IUCrData, 2020, 5, x200857
1558619 CIF
HKL
Paper
C32 H48 N12 O8 Os3 P4P b c a18.75; 15.8889; 27.5984
90; 90; 90
8222.03Marolf, David M.; Brehm, Kristen L.; Lynch, Vincent M.; Powell, Gregory L.
1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.1^3,7^]decane-κ<i>P</i>)-<i>triangulo</i>-triosmium(0)
IUCrData, 2020, 5, x200935
1558620 CIF
HKL
Paper
C17 H10 Br Cl2 N O2C 1 2/c 155.051; 3.8355; 35.979
90; 125.214; 90
6207Mayorova, Oksana A.; Grinev, Vyacheslav S.; Yegorova, Alevtina Yu.
(<i>Z</i>)-5-(4-Bromophenyl)-3-{[(3,5-dichlorophenyl)amino]methylidene}furan-2(3<i>H</i>)-one
IUCrData, 2020, 5, x200937
1558621 CIF
HKL
Paper
C93 H138 I Mo3 N3 S13P 3 1 c23.6627; 23.6627; 10.9815
90; 90; 120
5325Chen, Yueli; Wang, Bo; Fontenot, Patricia; Donahue, James P.
Tris[<i>N</i>,<i>N</i>-bis(3,5-di-<i>tert</i>-butylbenzyl)dithiocarbamato-κ^2^<i>S</i>,<i>S</i>']-μ~3~-sulfido-tris-μ~2~-disulfido-<i>triangulo</i>-trimolybdenum(IV) iodide
IUCrData, 2020, 5, x200939
1558656 CIF
HKL
Paper
C8 H12 Cu3 N5C 1 2 112.6825; 8.3355; 7.2205
90; 120.444; 90
658.07Corfield, Peter W. R.; Stavola, Thomas James
Poly[diethylammonium [tetra-μ~2~-cyanido-κ^8^<i>C</i>:<i>N</i>-tricuprate(I)]], a two-dimensional network solid
IUCrData, 2020, 5, x200968
1558657 CIF
HKL
Paper
C31 H26 Cl2 N2 OP -19.8084; 11.6806; 12.0754
77.474; 85.686; 80.742
1331.8Shraddha, K. N.; Begum, Noor Shahina
2-[1-(4-<i>tert</i>-Butylphenyl)-4,5-diphenyl-1<i>H</i>-imidazol-2-yl]-4,6-dichlorophenol
IUCrData, 2020, 5, x200870
1558658 CIF
HKL
Paper
C25 H29 Cl N2 O7P 21 21 219.2324; 11.1656; 23.3497
90; 90; 90
2407.01Outahar, Fatima; Moumou, Mohamed; Rakib, El Mostapha; Hannioui, Abdellah; Saadi, Mohamed; El Ammari, Lahcen
Ethyl 10α-hydroxy-4,9-dimethyl-14-oxo-3,8,15-trioxatetracyclo[10.3.0.0^2,4^.0^7,9^]pentadecane-13-spiro-5'-pyrazole-3'-carboxylate
IUCrData, 2020, 5, x200945
1558666 CIF
HKL
Paper
C15 H12.5 Cu I N2.5P -17.9004; 10.426; 10.5078
99.903; 104.93; 110.061
752.55Hoffman, Jessica L.; Akhigbe, Jessie E.; Reinheimer, Eric W.; Smucker, Bradley W.
Poly[[[μ-<i>trans</i>-1,2-bis(pyridin-4-yl)ethene-κ^2^<i>N</i>:<i>N</i>']-μ-iodido-copper(I)]‒<i>trans</i>-1,2-bis(pyridin-4-yl)ethene (1/0.25)]
IUCrData, 2020, 5, x200998
1558687 CIF
HKL
Paper
C19 H24 O5P 1 21/c 113.1494; 9.6899; 14.8185
90; 113.295; 90
1734.2Detert, Heiner; Kluge, Laura; Schollmeyer, Dieter
Methyl 3,3,6,6-tetramethyl-1,8-dioxo-4,5,7,9-tetrahydro-2<i>H</i>-xanthene-9-carboxylate
IUCrData, 2020, 5, x201018
1558688 CIF
HKL
Paper
C8 H6 N6 Pt S4P 1 21/c 16.1778; 7.77; 14.8862
90; 95.935; 90
710.73Siddiqui, Mahaa J.; Nesterov, Volodymyr V.; Steidle, Matthew T.; Smucker, Bradley W.
<i>trans</i>-Diamminebis(1,2-dicyanoethene-1,2-dithiolato)platinum(IV)
IUCrData, 2020, 5, x200980
1558724 CIF
HKL
Paper
C21 H15 F N2 O4 SP 1 21/c 19.8726; 15.8054; 11.8345
90; 94.679; 90
1840.51Wu, Mei-Fang; Chen, Ling-Yan; Li, Ya
3-(2,2-Dioxo-3,4-dihydrobenzo[<i>e</i>][1,2,3]oxathiazin-4-yl)-3-fluoro-1-phenylindolin-2-one
IUCrData, 2020, 5, x201028
1558815 CIF
HKL
Paper
Cl9 S UP 21 21 2110.534; 10.545; 11.217
90; 90; 90
1246Deubner, Holger Lars; Ivlev, Sergei I.; Kraus, Florian
Rerefinement of the crystal structure of trichloridosulfonium(IV) hexachloridouranate(V), (SCl~3~)[UCl~6~]
IUCrData, 2020, 5, x200960
1558816 CIF
HKL
Paper
C18 H22 Cd N8 O12P -17.191; 8.698; 10.987
112.289; 92.827; 101.656
616.7Ibragimov, Avazbek
Bis(3,5-dinitrobenzoato-κ<i>O</i>)bis(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)
IUCrData, 2020, 5, x200843
1558818 CIF
HKL
Paper
C25 H25 N3 O4P 21 21 217.8041; 22.8879; 25.267
90; 90; 90
4513.2Shripanavar, Chetan Shrimandhar; Butcher, Ray J.
(<i>Z</i>)-<i>N</i>'-[(<i>E</i>)-4-Methoxybenzylidene]-2-(methoxyimino)-2-{2-[(2-methylphenoxy)methyl]phenyl}acetohydrazide
IUCrData, 2020, 5, x201060
1558830 CIFC16 H15 N O4P -18.336; 10.178; 16.326
82.284; 76.557; 87.081
1334.73Araújo, Rodrigo S. A. de; Zondegoumba, Ernestine N. T.; Tankoua, Whisthler L. D.; Nyassé, Barthelemy; Mendonça, Francisco J. B. F.; De Simone, Carlos A.
1-Hydroxy-3,4-dimethoxy-10-methylacridin-9-one
IUCrData, 2020, 5, x201005
1558831 CIF
HKL
Paper
C11 H16 N2 SeP 1 21/n 112.0239; 7.1317; 12.6836
90; 101.104; 90
1067.27Detert, Heiner; Schollmeyer, Dieter
<i>rac</i>-12-Selena-13,14-diazatricyclo[9.3.0.0^2,4^]tetradeca-11,13-diene
IUCrData, 2020, 5, x201081
1558860 CIF
HKL
Paper
C18 H22 Ca O12P 1 21/n 15.3477; 26.6084; 7.7367
90; 106.715; 90
1054.37Camargo-Cortés, Esmit B.; Acosta, Mirna; Martínez, Juan C.; Pineda, Leslie W.
Tetraaquabis(2,3-dihydro-1,4-benzodioxine-2-carboxylato)calcium(II)
IUCrData, 2020, 5, x201092
1558931 CIF
HKL
Paper
C10 H11 N3 O6P -16.7463; 9.036; 9.3954
81.005; 85.099; 88.7
563.6Uppu, Sannihith N.; Agu, Ogad A.; Deere, Curtistine J.; Fronczek, Frank R.
<i>N</i>-(4-Ethoxy-2,5-dinitrophenyl)acetamide
IUCrData, 2020, 5, x201121
1559018 CIF
HKL
Paper
C10 H32 Cl2 N4 Ni O2F d d 224.7168; 16.6156; 8.3805
90; 90; 90
3441.7Miecznikowski, John R.; Jasinski, Jerry P.; Flaherty, Nicole F.; Mircovich, Emma E.; Smolinsky, Allison N.; Bertolotti, Natalia R.
<i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>,<i>N</i>'-trimethylethylenediamine)nickel(II) dichloride
IUCrData, 2020, 5, x201182
1559019 CIF
HKL
Paper
C11 H11 N O2P 1 21/c 15.5622; 18.891; 9.6524
90; 104.454; 90
982.1Lynch, Will E.; Whitlock, Christine R.; Padgett, Clifford W.
Ethyl 1<i>H</i>-indole-2-carboxylate
IUCrData, 2020, 5, x201205
1559020 CIF
HKL
Paper
C27 H38 O4P 21 21 217.4768; 16.219; 19.4101
90; 90; 90
2353.8Guerrero-Luna, Gabriel; Reyes Melchor, Jaquelin; Bernès, Sylvain; Hernández-Linares, María-Guadalupe
Diosgenin-3,6-dione: second polymorph in space group <i>P</i>2~1~2~1~2~1~
IUCrData, 2020, 5, x201200
1559021 CIF
HKL
Paper
C116 H112 O16 Os4 P4P 1 21/c 112.71423; 17.04149; 26.1784
90; 96.7054; 90
5633.26Zometa Paniagua, Diego F.; Powell, Gregory L.; Powell, Cynthia B.; Reinheimer, Eric W.
Bis(μ~4~-adamantane-1,3-dicarboxylato-1κ<i>O</i>^1^:2κ<i>O</i>^1'^:3κ<i>O</i>^3^:4κ<i>O</i>^3'^)octacarbonyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>,3κ^2^<i>C</i>,4κ^2^<i>C</i>-tetrakis[tris(4-methylphenyl)phosphane]-1κ<i>P</i>,2κ<i>P</i>,3κ<i>P</i>,4κ<i>P</i>-tetraosmium(I)(2 <i>Os</i>‒<i>Os</i>)
IUCrData, 2020, 5, x201204
1559022 CIF
HKL
Paper
C27 H18 N2P 1 21/n 19.642; 11.407; 17.858
90; 103.606; 90
1909Chen, Lin; Hu, Jin; Wu, Li-Li; Sun, Hong-Shun
11,11-Diphenyl-11<i>H</i>-indeno[1,2-<i>b</i>]quinoxaline
IUCrData, 2020, 5, x201213
1559023 CIF
HKL
Paper
C20 H16 O3P 1 21/n 112.4519; 7.8785; 15.668
90; 105.253; 90
1482.92Sung, Jiha
3-(2-Methoxyphenyl)-2,3-dihydro-1<i>H</i>-benzo[<i>f</i>]chromen-1-one
IUCrData, 2020, 5, x201209
1559074 CIF
HKL
Paper
C27 H19 F2 NP -19.394; 9.802; 11.914
88.983; 73.144; 69.488
979Fang, Yiwen; Liu, Bingbing; Jia, Zhixiang
6-(3,4-Difluorophenyl)-7,8,13,14-tetrahydrodibenzo[<i>c</i>,<i>k</i>]phenanthridine
IUCrData, 2020, 5, x201241
1559075 CIF
HKL
Paper
C28 H24 Co F6 Fe2 O6P -17.725; 12.721; 14.609
70.67; 82.88; 80.46
1332.3Wang, Shujing; Han, Heguo; Han, Yuyang
Diaquabis(4-ferrocenyl-1,1,1-trifluoro-4-oxobutan-2-olato)cobalt(II)
IUCrData, 2020, 5, x201240
1559092 CIF
HKL
Paper
C12 H16 Cl2 N8 O4P 1 21/c 113.2096; 4.9765; 13.5673
90; 98.603; 90
881.85Chakkarapani, Nandhini; Murugan, Suganya; Ibrahim, Abdul Razak; Kavitha, Savaridasan Jose; Hemamalini, Madhukar; Rajakannan, Venkatachalam
2,6-Diamino-4-chloropyrimidine‒succinic acid (2/1)
IUCrData, 2020, 5, x201239
1559093 CIF
HKL
Paper
C20 H14 N6P 1 21/c 18.4636; 9.8402; 22.701
90; 105.917; 90
1818.1Cai, Changting; Lin, Bicheng; Wu, Wenxuan; Zhu, Qingwei
(3<i>Z</i>,5<i>E</i>)-2-Amino-4,6-bis(pyridin-3-yl)hepta-1,3,5-triene-1,1,3-tricarbonitrile
IUCrData, 2020, 5, x201246
1559124 CIF
HKL
Paper
C40 H36 B2 N4 O5P 1 21/c 116.7584; 13.6696; 16.0291
90; 111.125; 90
3425.2Mallard, Hannah H.; Kennedy, Nicholas D.; Rudman, Nathan A.; Greenwood, Alexa M.; Nicoleau, Jonathan; Angle, Corey E.; Torquato, Nicole A.; Gau, Micheal R.; Carroll, Patrick J.; Anstey, Mitchell R.
2,2'-Oxybis[1,3-bis(4-methoxyphenyl)-2,3-dihydro-1<i>H</i>-benzo[<i>d</i>][1,3,2]diazaborole]
IUCrData, 2020, 5, x201248
1559209 CIF
HKL
Paper
C40 H24 Fe N14P -19.8291; 10.0499; 11.0308
98.825; 90.9; 117.747
948.19Setifi, Zouaoui; Setifi, Fatima; Dege, Necmi; Al-Douh, Mohammed Hadi; Glidewell, Christopher
Bis[tris(pyridin-2-yl)amine]iron(II) tris(dicyanomethylidene)methanediide
IUCrData, 2020, 5, x201278
1559210 CIF
HKL
Paper
C22 H21 N O4P 1 21/n 18.2694; 21.1783; 10.705
90; 111.117; 90
1748.89Whalen, Aislinn C.; Hernandez Brito, Claudia; Choi, Kyoung H.; Warner, Ellen J. T.; Thole, David A.; Gau, Michael R.; Carroll, Patrick J.; Anstey, Mitchell R.
10-Phenyl-10<i>H</i>-phenoxazine-4,6-diol tetrahydrofuran monosolvate
IUCrData, 2020, 5, x201276
1559211 CIF
HKL
Paper
C26 H48 N4 Si3P 1 21/c 120.6543; 8.365; 17.5215
90; 97.371; 90
3002.23Mizuhata, Yoshiyuki; Iwai, Kento; Tokitoh, Norihiro
2,2-Bis[3,5-bis(dimethylamino)phenyl]-1,1,1,3,3,3-hexamethyltrisilane
IUCrData, 2020, 5, x201299
1559228 CIF
HKL
Paper
C11 H17 Br O2P -17.577; 7.6838; 10.2038
101.843; 90.893; 104.642
561.11Schollmeyer, Dieter; Heidrich, Maximilian; Detert, Heiner
<i>rac</i>-(<i>E</i>,<i>trans</i>)-4-Bromo-10,10-dimethyl-9,11-dioxabicyclo[6.3.0]undec-4-ene
IUCrData, 2020, 5
1559229 CIF
HKL
Paper
C18 H13 Cl2 F3 N4 O3 S ZnP 1 21/n 17.655; 15.329; 18.486
90; 92.088; 90
2167.8Adrian, Rafael A.; Arman, Hadi D.
Chlorido(4'-chloro-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')(trifluoromethanesulfonato-κ<i>O</i>)zinc(II) acetonitrile monosolvate
IUCrData, 2020, 5
1559332 CIF
HKL
Paper
C6 H7 N3 O2P 1 21/c 17.413; 9.2858; 10.1238
90; 102.841; 90
679.45Padgett, Clifford W.; Sheriff, Kirkland; Lynch, Will E.
Pyridine-4-carboxamidoxime <i>N</i>-oxide
IUCrData, 2020, 5, x201335
1559333 CIF
HKL
Paper
C9 H13 N3 OC 1 2/c 124.7018; 6.3093; 13.2103
90; 118.05; 90
1817.01Kelley, Steven P.; Mossine, Valeri V.; Mawhinney, Thomas P.
4-(Dimethylamino)benzohydrazide
IUCrData, 2020, 5, x201310
1559354 CIF
HKL
C15 H10 Cl N5 O6 ZnP -112.1001; 13.3139; 13.4869
62.471; 63.694; 87.388
1692.2Adrian, Rafael A.; Canales, Daniela; Arman, Hadi D.
(4'-Chloro-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')bis(nitrato-κ<i>O</i>)zinc(II)
IUCrData, 2020, 5, x201344
1559391 CIF
HKL
Paper
C12 H12 O3P 1 21/c 16.3136; 11.6138; 12.633
90; 95.292; 90
922.36Kotha, Sambasivarao; Ansari, Saima; Cheekatla, Subba Rao
7-Methoxypentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,9^]undecane-8,11-dione
IUCrData, 2020, 5, x201380
1559407 CIF
HKL
Paper
C14 H12 N2 O4P 1 21/c 16.5499; 7.6232; 25.6211
90; 96.216; 90
1271.77Böhme, Uwe; Fels, Sabine
6-[(2-Hydroxy-5-methylanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one
IUCrData, 2020, 5, x201384
1559408 CIF
HKL
C12 H10 O6P c a 2125.006; 5.0337; 8.5646
90; 90; 90
1078.05Tiouabi, Mustapha; Tabacchi, Raphaël; Stoeckli-Evans, Helen
(8-Hydroxy-6-methoxy-1-oxo-1<i>H</i>-isochromen-3-yl)methyl formate: a supramolecular framework
IUCrData, 2020, 5, x201391
1559417 CIF
HKL
Paper
Al2.95 Cr0.59C 1 2/c 117.7519; 30.485; 17.7526
90; 91.061; 90
9605.5Geng, Xu; Wen, Bin; Fan, Changzeng
Crystal structure of Al2.95Cr0.59, a phase closely related to the η-phase in the binary Al‒Cr system
IUCrData, 2020, 5
1559437 CIF
HKL
Paper
C18 H23 N O7P 1 21/c 19.9429; 9.3845; 20.7845
90; 91.55; 90
1938.67Dallasta Pedroso, Sofia; Caracelli, Ignez; Zukerman-Schpector, Julio; Soto-Monsalve, Monica; De Almeida Santos, Regina H.; Correia, Carlos Roque D.; Llanes Garcia, Ariel L.; Tiekink, Edward R. T.
Ethyl 3,4-bis(acetyloxy)-2-(4-methoxyphenyl)pyrrolidine-1-carboxylate
IUCrData, 2020, 5, x201228
1559484 CIF
HKL
Paper
C8 H16 N2 SiP 21 21 216.1056; 10.8114; 15.5867
90; 90; 90
1028.88Böhme, Uwe; Bitto, Florian
(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)trimethylsilane
IUCrData, 2020, 5, x201444
1559529 CIF
HKL
Paper
C12 H13 Br N2 SP 1 21/c 116.2976; 6.1294; 12.2221
90; 99.07; 90
1205.65Eigner, Václav
Crystal structure of 2-[(naphthalen-2-yl)methyl]isothiouronium bromide
IUCrData, 2020, 5, x201511

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