Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1546655 | CIF HKL Paper | C19 H19 N3 | P c a 21 | 14.054; 11.2639; 9.6184 90; 90; 90 | 1522.62 | González, Gerardo García; Unnamatla, M. V. Basavanag 9-(1<i>H</i>-Benzo[<i>d</i>]imidazol-2-yl)-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-pyrido[3,2,1-<i>ij</i>]quinoline IUCrData, 2017, 2, x170445 |
| 1546656 | CIF HKL Paper | C16 H10 O4 | P -1 | 6.9243; 7.7262; 11.8168 84.55; 81.852; 83.023 | 619.22 | Kambo, Konan René; Sosso, Siaka; Mansilla-Koblavi, F.; Djandé, Abdoulaye; Kakou-Yao, Rita 2-Oxo-2<i>H</i>-chromen-3-yl benzoate IUCrData, 2017, 2, x170663 |
| 1546657 | CIF HKL Paper | C22 H18 N3 O3.5 | P 1 21/c 1 | 4.9634; 14.0708; 25.7168 90; 90.602; 90 | 1795.94 | Filali Baba, Yassir; Kandri Rodi, Youssef; Ouzidan, Younes; Mague, Joel T.; Ouazzani Chahdi, Fouad; Essassi, El Mokhtar (Pyridin-2-yl)methyl 2-oxo-1-[(pyridin-2-yl)methyl]-1,2-dihydroquinoline-4-carboxylate hemihydrate IUCrData, 2017, 2, x171038 |
| 1546658 | CIF HKL Paper | C12 H13 Cl2 N O2 | P b c a | 13.9866; 7.9972; 23.122 90; 90; 90 | 2586.3 | Mohamooda Sumaya, U.; Reuben Jonathan, D.; Era, Dravida Thendral; Gomathi, S.; Usha, G. (2,4-Dichlorophenyl)(3-hydroxypiperidin-1-yl)methanone: crystal structure and Hirshfeld analysis IUCrData, 2017, 2, x170813 |
| 1546659 | CIF HKL Paper | C20 H30 N2 O2 | C 1 2/c 1 | 13.357; 9.209; 16.743 90; 113.277; 90 | 1891.8 | El Bourakadi, Khadija; El Bakri, Youness; Sebhaoui, Jihad; Rayni, Ibtissam; Essassi, El Mokhtar; Mague, Joel T. 1,4-Dihexyl-1,2,3,4-tetrahydroquinoxaline-2,3-dione IUCrData, 2017, 2, x171019 |
| 1546660 | CIF HKL Paper | C33 H47 N O S | P 1 21/c 1 | 33.8411; 4.7106; 18.0987 90; 90.47; 90 | 2885.05 | Sebbar, Nada Kheira; Ellouz, Mohamed; Lahmidi, Sanae; Hlimi, Fouzia; Essassi, El Mokhtar; Mague, Joel T. (2<i>Z</i>)-2-Benzylidene-4-octadecyl-3,4-dihydro-2<i>H</i>-1,4-benzothiazin-3-one IUCrData, 2017, 2, x170695 |
| 1546661 | CIF HKL Paper | C22 H19 N3 O | P 1 21/n 1 | 5.7619; 22.1304; 13.6271 90; 99.102; 90 | 1715.75 | Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Marzouk, Adel A.; Albayati, Mustafa R. 2-[4,5-Diphenyl-2-(pyridin-4-yl)-1<i>H</i>-imidazol-1-yl]ethanol IUCrData, 2017, 2, x170132 |
| 1546662 | CIF HKL | C22 H21 N5 O | P -1 | 8.5878; 9.0603; 12.8566 85.076; 82.558; 70.917 | 936.4 | Adardour, Mohamed; Loughzail, Mohamed; Dahaoui, Slimane; Baouid, Abdesselam; Berraho, Moha 1-(Cyclohex-1-en-1-yl)-3-[(1-phenyl-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-1<i>H</i>-benzimidazol-2(3<i>H</i>)-one IUCrData, 2017, 2, x170907 |
| 1546663 | CIF HKL Paper | C17 H16 N4 | P 1 21 1 | 9.968; 15.529; 10.119 90; 102.558; 90 | 1528.9 | Raghuvarman, B.; Gayathri, Jayagopi; Selvan, Kumar Sangeetha; Sugumar, P.; Ponnuswamy, M. N. (<i>E</i>)-<i>N</i>-(1<i>H</i>-Pyrrol-2-ylmethylidene)-2-{[(<i>E</i>)-(1<i>H</i>-pyrrol-2-ylmethylidene)amino]methyl}aniline IUCrData, 2017, 2, x170540 |
| 1546664 | CIF HKL Paper | C67 H72 B Br Fe N2 O P2 | P 1 | 12.8083; 14.637; 18.9082 106.916; 98.406; 110.635 | 3048.9 | Smith, Samantha A. M.; Lough, Alan J.; Morris, Robert H. Bromidocarbonyl{(1<i>S</i>,2<i>S</i>)-<i>N</i>-[2-(dicyclohexylphosphanyl)ethylidenyl]-<i>N</i>'-[2-(diphenylphosphanyl)ethyl]-1,2-diphenylethane-1,2-diamine}iron(II) tetraphenylborate IUCrData, 2017, 2, x170452 |
| 1546665 | CIF HKL Paper | C8 H15 N O5 S | P 1 21 1 | 9.4093; 10.5822; 12.2844 90; 107.64; 90 | 1165.66 | Laus, Gerhard; Wurst, Klaus; Nerdinger, Sven; Richter, Frank; Schottenberger, Herwig (<i>R</i>)-3-(<i>tert</i>-Butoxycarbonyl)-5-methyl-1,2,3-oxathiazolidine 2,2-dioxide IUCrData, 2017, 2, x170869 |
| 1546666 | CIF HKL | C14 H9 Cl4 N3 O2 | P 1 21/c 1 | 5.6382; 13.622; 20.662 90; 92.289; 90 | 1585.6 | Riad, Noura M.; Zlotos, Darius P.; Holzgrabe, Ulrike 3-(2-Chloropyridin-3-yl)quinazoline-2,4(1<i>H</i>,3<i>H</i>)-dione chloroform monosolvate IUCrData, 2017, 2, x170580 |
| 1546667 | CIF HKL Paper | C18 H20 N2 O2 | P -1 | 8.6864; 8.9925; 10.9872 110.653; 95.111; 104.723 | 761.42 | Sebhaoui, Jihad; El Bakri, Youness; Rayni, Ibtissam; El Bourakadi, Khadija; Essassi, El Mokhtar; Mague, Joel T. (4<i>Z</i>)-4-(2-Oxopropylidene)-1,3-bis(prop-2-en-1-yl)-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-2-one IUCrData, 2017, 2, x170493 |
| 1546668 | CIF HKL Paper | C9 H12 Cl N | P -1 | 6.9617; 7.5941; 9.464 86.06; 82.118; 67.102 | 456.5 | Bentivoglio, Gino; Laus, Gerhard; Kahlenberg, Volker; Röder, Thomas; Schottenberger, Herwig 1-Allyl-2-methylpyridinium chloride IUCrData, 2017, 2, x170598 |
| 1546669 | CIF HKL Paper | C21 H21 N O | P 1 21/c 1 | 10.721; 13.7039; 11.5761 90; 107.032; 90 | 1626.16 | Louroubi, Abdelhadi; Outouch, Rachid; Ait Ali, Mustapha; Spannenberg, Anke; El Firdoussi, Larbi 1-(1-Benzyl-2,5-dimethyl-4-phenyl-1<i>H</i>-pyrrol-3-yl)ethanone IUCrData, 2017, 2, x170895 |
| 1546670 | CIF HKL Paper | C13 H12 N6 O2 | P n a 21 | 20.333; 14.2764; 4.5089 90; 90; 90 | 1308.85 | Sahbi, Azzeddine; Mague, Joel T.; Ben-Tama, Abdeslem; El Hadrami, El Mestafa; Gaamoussi, Issam; Ouzidan, Younes 4-[(1<i>H</i>-Imidazol-1-yl)methyl]-1-(4-nitrobenzyl)-1<i>H</i>-1,2,3-triazole IUCrData, 2017, 2, x170515 |
| 1546671 | CIF HKL Paper | C14 H12 Br N3 O | P 1 21/c 1 | 14.8643; 7.6795; 12.069 90; 108.465; 90 | 1306.75 | Bourichi, Selma; Kandri Rodi, Youssef; Jasinski, Jerry P.; Kaur, Manpreet; El Hadrami, El Mestafa; Essassi, El Mokhtar 6-Bromo-2-(4-methoxyphenyl)-3-methyl-3<i>H</i>-imidazo[4,5-<i>b</i>]pyridine IUCrData, 2017, 2, x171071 |
| 1546672 | CIF HKL Paper | C7 H8 N2 O2 | P 1 21 1 | 3.8872; 6.8386; 13.6279 90; 93.303; 90 | 361.67 | Rillema, D. Paul; KomReddy, Venugopal; Senaratne, Nilmini K.; Eichhorn, David M. Methyl 5-methylpyrazine-2-carboxylate IUCrData, 2017, 2, x170997 |
| 1546673 | CIF HKL Paper | C22 H14 Cl N O2 S | P b c a | 9.2518; 10.3432; 38.5674 90; 90; 90 | 3690.64 | Bakhouch, Mohamed; El Yazidi, Mohamed; Al Houari, Ghali; Saadi, Mohamed; El Ammari, Lahcen 3'-(4-Chlorophenyl)-4'-phenyl-3<i>H</i>,4'<i>H</i>-spiro[benzo[<i>b</i>]thiophene-2,5'-isoxazol]-3-one IUCrData, 2017, 2, x170677 |
| 1546674 | CIF HKL Paper | C22 H17 Cl N2 O2 | I 1 2/a 1 | 29.2234; 8.3076; 31.0407 90; 101.859; 90 | 7375.1 | El Janati, Ali; Kandri Rodi, Youssef; Jasinski, Jerry P.; Kaur, Manpreet; Ouzidan, Younes; Essassi, El Mokhtar 1,4-Dibenzyl-6-chloroquinoxaline-2,3(1<i>H</i>,4<i>H</i>)-dione IUCrData, 2017, 2, x170901 |
| 1546675 | CIF HKL Paper | C9 H8 Cl N3 O2 | P 1 21/c 1 | 7.4984; 16.2805; 8.3363 90; 97.403; 90 | 1009.19 | Mohamed Abdelahi, Mohamed Mokhtar; Sebbar, Nada Kheira; Jasinski, Jerry P.; Kaur, Manpreet; Essassi, El Mokhtar; Benchidmi, Mohammed 3-Chloro-1-ethyl-6-nitro-1<i>H</i>-indazole IUCrData, 2017, 2, x170972 |
| 1546676 | CIF HKL Paper | C36 H60 Si6 | P -1 | 9.6036; 10.806; 11.4686 108.617; 100.558; 109.477 | 1005.91 | Mizuhata, Yoshiyuki; Omatsu, Yamato; Tokitoh, Norihiro Dodecaallylhexasilacyclohexane IUCrData, 2017, 2, x170807 |
| 1546677 | CIF HKL Paper | C23 H25 F N4 O7 | P 1 21 1 | 11.1688; 9.0576; 11.9237 90; 106.77; 90 | 1154.93 | Qachchachi, Fatima-Zahrae; Mague, Joel T.; Kandri Rodi, Youssef; Haoudi, Amal; El Hadrami, El Mestafa; Essassi, El Mokhtar 5-Fluoro-1-[(1-{[(1<i>S</i>,2<i>R</i>,6<i>R</i>,8<i>S</i>,9<i>R</i>)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^2,6^]dodecan-8-yl]methyl}-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-2,3-dihydro-1<i>H</i>-indole-2,3-dione IUCrData, 2017, 2, x170739 |
| 1546678 | CIF HKL Paper | C10 H7 Br2 N O | P 1 21/c 1 | 16.158; 3.996; 17.551 90; 115.316; 90 | 1024.4 | Çelik, Ísmail; Ökten, Salih; Akkurt, Mehmet; Ersanlı, Cem Cüneyt; Çakmak, Osman; Özbakır, Rana 5,7-Dibromo-8-methoxyquinoline IUCrData, 2017, 2, x170643 |
| 1546679 | CIF HKL Paper | C18 H20 N2 O4 | P -1 | 8.5948; 10.1942; 10.2572 74.93; 75.306; 89.866 | 837.5 | Kaoukabi, Hanane; Taourirte, Moha; El Azhari, Mohamed; Lazrek, Hassan B.; Saadi, Mohamed; El Ammari, Lahcen 5-Acetyl-4-(2,5-dimethoxyphenyl)-6-methyl-1-(prop-2-ynyl)-3,4-dihydropyrimidin-2(1<i>H</i>)-one IUCrData, 2017, 2, x170816 |
| 1546680 | CIF HKL Paper | C19 H18 Cl N O S | P -1 | 8.8898; 8.9885; 12.1973 89.908; 84.49; 63.534 | 867.53 | Ellouz, Mohamed; Sebbar, Nada Kheira; Ouzidan, Younes; Kaur, Manpreet; Essassi, El Mokhtar; Jasinski, Jerry P. (<i>Z</i>)-4-<i>n</i>-Butyl-2-(4-chlorobenzylidene)-2<i>H</i>-1,4-benzothiazin-3(4<i>H</i>)-one IUCrData, 2017, 2, x170870 |
| 1546681 | CIF HKL Paper | C7 H5 Cl2 N O2 | P 21 21 21 | 3.8145; 12.4829; 17.4438 90; 90; 90 | 830.6 | Medjroubi, Mohamed Larbi; Boudjada, Ali; Hamdouni, Noudjoud; Jeannin, Olivier; Meinnel, Jean 2,6-Dichloro-4-nitrotoluene IUCrData, 2017, 2, x170672 |
| 1546682 | CIF HKL Paper | C19 H19 N O S | P -1 | 7.7711; 10.9897; 11.409 112.013; 109.259; 98.12 | 812.78 | Sebbar, Nada Kheira; Ellouz, Mohamed; Ouzidan, Younes; Kaur, Manpreet; Essassi, El Mokhtar; Jasinski, Jerry P. (<i>Z</i>)-2-Benzylidene-3-<i>n</i>-butoxy-2<i>H</i>-1,4-benzothiazine IUCrData, 2017, 2, x170890 |
| 1546683 | CIF HKL Paper | C9 H8 Cl N3 O2 | P 1 21/c 1 | 11.2363; 7.4063; 12.1247 90; 111.051; 90 | 941.67 | Mohamed Abdelahi, Mohamed Mokhtar; El Bakri, Youness; Minnih, Mohamed Said; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 3-Chloro-2-ethyl-6-nitro-2<i>H</i>-indazole IUCrData, 2017, 2, x170652 |
| 1546684 | CIF HKL Paper | C20 H18 N4 O | P 1 21/c 1 | 18.2838; 7.7956; 11.8081 90; 100.393; 90 | 1655.4 | Ghandour, Ismail; Mague, Joel T.; Bouayad, Abdelouahed; Chakroune, Said; Essassi, El Mokhtar; Kandri Rodi, Youssef 5-Methyl-4-(3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-3-one IUCrData, 2017, 2, x170853 |
| 1546685 | CIF HKL Paper | C11 H14 Cl N | P 1 21/n 1 | 8.1093; 9.1624; 14.6575 90; 94.241; 90 | 1086.08 | Partl, Gabriel; Bentivoglio, Gino; Laus, Gerhard; Gelbrich, Thomas; Wurst, Klaus; Huppertz, Hubert; Schottenberger, Herwig 1-Allyl-2,3-cyclopentenopyridinium chloride IUCrData, 2017, 2, x170669 |
| 1546686 | CIF HKL Paper | C17 H19 N3 O | P 1 21/c 1 | 19.6067; 5.5438; 14.0069 90; 99.911; 90 | 1499.77 | Benyahya, Mohamed Ali; El Azzaoui, Brahim; Sebbar, Nada Kheira; Ouzidan, Younes; Essassi, El Mokhtar; Mague, Joel T. 5,6-Dimethyl-2-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-(prop-2-en-1-yl)-1<i>H</i>-1,3-benzodiazole IUCrData, 2017, 2, x170647 |
| 1546687 | CIF HKL Paper | C19 H12 Cl2 N2 O4 S3 | P -1 | 7.133; 8.1155; 17.798 87.747; 81.84; 87.849 | 1018.5 | Watkins, Sydney M.; Hagen, Timothy J.; Perkins, Timothy S.; Zheng, Chong (<i>Z</i>)-4-Chloro-<i>N</i>-{3-[(4-chlorophenyl)sulfonyl]-2,3-dihydrobenzo[<i>d</i>]thiazol-2-ylidene}benzenesulfonamide IUCrData, 2017, 2, x170865 |
| 1546688 | CIF HKL Paper | C6 H6 Br2 N2 | P 1 21/n 1 | 13.1047; 4.031; 15.7631 90; 105.72; 90 | 801.54 | Krishna Murthy, P.; Sreenivasa Rao, R.; Suneetha, V.; Giri, L.; Suchetan, P. A. 3,5-Dibromo-6-methylpyridin-2-amine IUCrData, 2017, 2, x170728 |
| 1546689 | CIF HKL Paper | C15 H11 N O | P 1 21/c 1 | 13.463; 3.8694; 20.377 90; 101.023; 90 | 1041.9 | Sebhaoui, Jihad; El Bakri, Youness; Essassi, El Mokhtar; Mague, Joel T. (<i>E</i>)-<i>N</i>-[(Anthracen-9-yl)methylidene]hydroxylamine IUCrData, 2017, 2, x170684 |
| 1546690 | CIF HKL Paper | C25 H36 N2 O | P 1 21 1 | 8.9303; 15.572; 9.4824 90; 117.32; 90 | 1171.6 | Rani, C. Vidya; Mitu, L.; Chakkaravarthi, G.; Rajagopal, G. 4,6-Di-<i>tert</i>-butyl-2-({[4-(diethylamino)phenyl]imino}methyl)phenol IUCrData, 2017, 2, x170572 |
| 1546691 | CIF HKL Paper | C7 N4 S3 | P 21 21 21 | 6.1657; 7.0875; 20.883 90; 90; 90 | 912.6 | Tomura, Masaaki 2-Sulfanylidene-1,3-dithiolo[4,5-<i>b</i>]pyrazine-5,6-dicarbonitrile IUCrData, 2017, 2, x171023 |
| 1546692 | CIF HKL Paper | C23 H26 N6 O2 | P 1 21/c 1 | 14.9353; 15.0367; 19.4231 90; 98.13; 90 | 4318.2 | Morris, Patrick J.; Moore, Curtis; Thomas, Craig J. Apilimod IUCrData, 2017, 2, x170693 |
| 1546693 | CIF HKL Paper | C27 H32 Br N O5 | P 1 21/n 1 | 10.1174; 19.0567; 14.0387 90; 105.254; 90 | 2611.4 | Mohamed, Shaaban K.; Dege, Necmi; Akkurt, Mehmet; Allah, Omyma A. Abd; Albayati, Mustafa R. Ethyl 2-[9-(5-bromo-2-hydroxyphenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetate IUCrData, 2017, 2, x170573 |
| 1546694 | CIF HKL | C72 H80 N6 O9 | R -3 :H | 26.3932; 26.3932; 24.827 90; 90; 120 | 14977.5 | Wrobel, Norma; Witulski, Bernhard; Schollmeyer, Dieter; Detert, Heiner 1,4,9,12-Tetramethoxy-14-octyl-5,8-dihydrodiindolo[3,2-<i>b</i>;2',3'-<i>h</i>]carbazole with an unknown solvent IUCrData, 2017, 2, x170462 |
| 1546695 | CIF HKL | C18 H27 Cl2 N O | P 61 | 10.5372; 10.5372; 29.971 90; 90; 120 | 2881.92 | Benharref, Ahmed; El Ammari, Lahcen; Saadi, Mohamed; Taourirte, Moha; Oukhrib, Abdelouahd; Berraho, Moha <i>N</i>-[(1a<i>R</i>,5a<i>R</i>,8<i>R</i>,9a<i>R</i>)-1,1-Dichloro-1a,5,5,7-tetramethyl-1a,2,3,4,5,5a,8,9-octahydro-1<i>H</i>-benzo[<i>a</i>]cyclopropa[<i>b</i>][7]annulen-8-yl]acetamide IUCrData, 2017, 2, x170492 |
| 1546696 | CIF HKL Paper | C20 H22 N4 O3 | P -1 | 9.4118; 10.8934; 18.6996 101.629; 91.752; 90.351 | 1876.83 | Sahbi, Azzeddine; Mague, Joel T.; Ben-Tama, Abdeslem; El Hadrami, El Mestafa; El Aroussi, Fatima; Ouzidan, Younes 4-{[5-Methyl-2-(propan-2-yl)phenoxy]methyl}-1-(4-nitrobenzyl)-1<i>H</i>-1,2,3-triazole IUCrData, 2017, 2, x170516 |
| 1546697 | CIF HKL Paper | C37 H76 B N3 O Si4 | P 1 21/n 1 | 12.9107; 17.872; 21.6094 90; 95.0374; 90 | 4966.9 | Oberparleiter, Stefan; Laus, Gerhard; Gelbrich, Thomas; Wurst, Klaus; Kunze-Liebhäuser, Julia; Schottenberger, Herwig Hexaethylguanidinium tetrakis(trimethylsilylethynyl)borate diethyl ether monosolvate IUCrData, 2017, 2, x170724 |
| 1546698 | CIF HKL Paper | C11 H14 N2 O2 S2 | P 1 21/n 1 | 7.7829; 7.4284; 21.9087 90; 94.399; 90 | 1262.91 | Nath, Paras; Bharty, Manoj K.; Butcher, Ray J.; Jasinski, Jerry P. <i>N</i>'-[Bis(methylsulfanyl)methylidene]-2-methoxybenzohydrazide IUCrData, 2017, 2, x170489 |
| 1546699 | CIF HKL Paper | C14 H14 N2 O2 | P -1 | 8.4015; 9.0041; 9.1465 114.214; 101.275; 90.978 | 615.19 | El Bourakadi, Khadija; El Bakri, Youness; Sebhaoui, Jihad; Rayni, Ibtissam; Essassi, El Mokhtar; Mague, Joel T. 1-(Prop-2-en-1-yl)-3-[(prop-2-en-1-yl)oxy]quinoxalin-2(1<i>H</i>)-one IUCrData, 2017, 2, x170656 |
| 1546700 | CIF HKL Paper | C18 H12 O4 | P 1 21/n 1 | 7.2074; 13.1851; 14.848 90; 102.505; 90 | 1377.5 | Yang, Fan; Li, Yang; Zhou, Shu-Jing 5-Hydroxy-2-phenyl-7-(prop-2-yn-1-yloxy)-4<i>H</i>-chromen-4-one IUCrData, 2017, 2, x170490 |
| 1546701 | CIF HKL Paper | C16 H22 O4 | P 1 21/n 1 | 6.767; 6.817; 15.864 90; 99.391; 90 | 722 | Raj, Radhakrishnan Mohan; Lekha, Logu; Viswanathan, Vijayan; Velmurugan, Devadasan; Easwaramoorthy, Deivanayagam 1,4-Bis[(oxan-2-yl)oxy]benzene IUCrData, 2017, 2, x170717 |
| 1546702 | CIF HKL Paper | C26 H22 N4 O2 | C 1 c 1 | 47.514; 7.1015; 6.1289 90; 96.037; 90 | 2056.5 | Faizi, Md. Serajul Haque; Dege, Necmi; Goleva, Kateryna 2-{(<i>E</i>)-[(4-Anilinophenyl)imino]methyl}-4-[(<i>E</i>)-(4-methoxyphenyl)diazenyl]phenol IUCrData, 2017, 2, x170548 |
| 1546703 | CIF HKL | C13 H18 O | P 21 21 21 | 4.8462; 7.8042; 30.996 90; 90; 90 | 1172.3 | Zhang, Lang-Jing; Kou, Jun-Feng; Liu, Feng-Yi 4-(2,4,6-Trimethylphenyl)butan-2-one IUCrData, 2017, 2, x170675 |
| 1546704 | CIF HKL Paper | C10 H9 N O2 | P -1 | 8.7148; 13.5652; 14.7832 91.562; 96.341; 103.776 | 1684.4 | Perez, Matthew F.; Desikan, Vasumathi; Golen, James A.; Manke, David R. 5,7-Dimethyl-1<i>H</i>-indole-2,3-dione IUCrData, 2017, 2, x170444 |
| 1546705 | CIF HKL Paper | C19 H16 O3 S | P c a 21 | 33.2932; 7.9284; 5.7903 90; 90; 90 | 1528.42 | Olszowy, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz Biphenyl-4-yl 4-methylbenzenesulfonate IUCrData, 2017, 2, x170982 |
| 1546706 | CIF HKL Paper | C15 H10 Br N3 O3 | P 1 21/c 1 | 13.269; 15.6721; 7.2136 90; 99.029; 90 | 1481.5 | Boulhaoua, Mohammed; Benchidmi, Mohammed; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen 2-(3-Bromo-5-nitro-1<i>H</i>-indazol-1-yl)-1-phenylethanone IUCrData, 2017, 2, x170559 |
| 1546707 | CIF HKL | C23 H21 N2 O0.5 | I 1 2/a 1 | 22.1001; 6.7624; 24.5714 90; 104.835; 90 | 3549.8 | Loughzail, Mohamed; Adardour, Mohamed; Dahaoui, Slimane; Baouid, Abdesselam (<i>E</i>)-2-Phenyl-4-styryl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine hemihydrate IUCrData, 2017, 2, x171070 |
| 1546708 | CIF HKL Paper | C23 H26 N4 O7 | C 1 2 1 | 25.6622; 8.7731; 10.3928 90; 101.847; 90 | 2289.96 | Qachchachi, Fatima-Zahrae; Mague, Joel T.; Kandri Rodi, Youssef; Haoudi, Amal; Ben-Tama, Abdeslem; Essassi, El Mokhtar 1-[(1-{[(1<i>S</i>,2<i>R</i>,6<i>R</i>,8<i>R</i>,9<i>S</i>)-4,4,11,11-Tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^2,6^]dodecan-8-yl]methyl}-1<i>H</i>-1,2,3-triazol-4-yl)methyl]-2,3-dihydro-1<i>H</i>-indole-2,3-dione IUCrData, 2017, 2, x170670 |
| 1546709 | CIF HKL Paper | C19 H13 Br Cl N3 | P -1 | 8.7749; 9.9403; 10.4475 76.03; 66.511; 85.843 | 810.76 | Bourichi, Selma; Kandri Rodi, Youssef; Jasinski, Jerry P.; Kaur, Manpreet; Ouzidan, Younes; Essassi, El Mokhtar 4-Benzyl-6-bromo-2-(4-chlorophenyl)-4<i>H</i>-imidazo[4,5-<i>b</i>]pyridine IUCrData, 2017, 2, x170899 |
| 1546710 | CIF HKL Paper | C17 H14 N2 O3 | P 1 21/c 1 | 17.9752; 17.4403; 9.2472 90; 102.892; 90 | 2825.9 | Essaghouani, Abdelhanine; Boulhaoua, Mohammed; El Hafi, Mohamed; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 2-(2-Oxo-4-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepin-1-yl)acetic acid IUCrData, 2017, 2, x170120 |
| 1546711 | CIF HKL | C11 H9 F3 N2 O3 S | P b c a | 7.37174; 12.5726; 26.4454 90; 90; 90 | 2451.01 | Abe, Ryosuke; Takase, Tsugiko; Oyama, Dai 2-(Pyridin-2-yl)pyridinium trifluoromethanesulfonate IUCrData, 2017, 2, x170689 |
| 1546712 | CIF HKL Paper | C9 H6 Br N3 O3 | P 1 21/n 1 | 13.9863; 7.8783; 18.5549 90; 100.786; 90 | 2008.41 | Mohamed Abdelahi, Mohamed Mokhtar; El Bakri, Youness; Minnih, Mohamed Said; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 1-(3-Bromo-6-nitro-1<i>H</i>-indazol-1-yl)ethan-1-one IUCrData, 2017, 2, x170660 |
| 1546713 | CIF HKL Paper | C18 H36 N2 P2 | P -1 | 11.3277; 12.3257; 15.5274 112.59; 90.7806; 92.9221 | 1997.74 | Höhne, Martha; Spannenberg, Anke; Müller, Bernd H.; Rosenthal, Uwe 1,1'-(Diphosphene-1,2-diyl)bis(2,2,6,6-tetramethylpiperidine) IUCrData, 2017, 2, x170903 |
| 1546714 | CIF HKL Paper | C10 H9 N S | P 1 21/n 1 | 6.0108; 7.9243; 19.8388 90; 94.271; 90 | 942.33 | Khan, Ezzat; Shahzad, Adnan; Tahir, M. Nawaz; Ateeq, Muhammad (2<i>E</i>)-3-Phenylprop-2-en-1-yl thiocyanate IUCrData, 2017, 2, x170549 |
| 1546715 | CIF HKL Paper | C18 H12 Cl N O S | P 1 21/c 1 | 13.3937; 8.9106; 13.394 90; 99.765; 90 | 1575.36 | Sebbar, Nada Kheira; Ellouz, Mohamed; Ouzidan, Younes; Kaur, Manpreet; Essassi, El Mokhtar; Jasinski, Jerry P. (<i>Z</i>)-2-(2-Chlorobenzylidene)-4-(prop-2-ynyl)-2<i>H</i>-1,4-benzothiazin-3(4<i>H</i>)-one IUCrData, 2017, 2, x170889 |
| 1546716 | CIF HKL Paper | C15 H16 O5 S | P -1 | 7.8066; 8.9238; 11.9303 106.583; 94.701; 111.358 | 725.58 | Olszowy, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz 3,5-Dimethoxyphenyl 4-methylbenzenesulfonate IUCrData, 2017, 2, x170980 |
| 1546717 | CIF HKL Paper | C28 H29 N5 O | P 1 21/c 1 | 9.894; 10.1125; 24.8655 90; 95.096; 90 | 2478.04 | Boukhssas, Salaheddine; Aouine, Younas; Faraj, Hassane; Alami, Anouar; El Hallaoui, Abdelilah; Zouihri, Hafid Dibenzyl({1-[(4-methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl]-1<i>H</i>-1,2,3-triazol-4-yl}methyl)amine IUCrData, 2017, 2, x170860 |
| 1546718 | CIF HKL | C15 H17 N O2 | P n m a | 15.6744; 6.9475; 11.988 90; 90; 90 | 1305.47 | Benharref, Ahmed; El Ammari, Lahcen; Saadi, Mohamed; Mazoir, Noureddine; Daran, Jean-Claude; Berraho, Moha 2-Isopropyl-4,7-dimethyl-1-nitronaphthalene IUCrData, 2017, 2, x170584 |
| 1546719 | CIF HKL Paper | C50 H70 Co N4 O2 | P -1 | 11.946; 13.218; 17.434 109.348; 96.35; 98.881 | 2527.33 | Rani, C.Vidya; Mitu, L.; Chakkaravarthi, G.; Rajagopal, G. Bis(4,6-di-tert-butyl-2-{N-[4-(diethylamino)phenyl]carboximidoyl}phenolato)cobalt(II) IUCrData, 2017, 2, x170784 |
| 1546720 | CIF HKL Paper | C13 H13 N O3 | P n m a | 12.2269; 6.7034; 14.0817 90; 90; 90 | 1154.16 | Filali Baba, Yassir; Kandri Rodi, Youssef; Hayani, Sonia; Jasinski, Jerry P.; Kaur, Manpreet; Essassi, El Mokhtar Ethyl 1-methyl-2-oxo-1,2-dihydroquinoline-4-carboxylate IUCrData, 2017, 2, x170917 |
| 1546721 | CIF HKL Paper | C19 H18 N2 O4 | P -1 | 8.5041; 8.6959; 12.5024 71.002; 88.165; 72.572 | 831.87 | Ramli, Youssef; Akrad, Rachida; Guerrab, Walid; Taoufik, Jamal; Ansar, Mhamed; Mague, Joel T. Ethyl 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetate IUCrData, 2017, 2, x170098 |
| 1546722 | CIF HKL Paper | C14 H12 Cl N O2 | P 1 21/c 1 | 14.201; 7.3285; 12.974 90; 105.89; 90 | 1298.6 | Manjunath, N. K.; Nabil Najib, A. A.; Nagendra, P.; Siddaraju, B. P; Swamy, M. T.; Byrappa, K.; Madan Kumar, S. 4-Chloro-2-nitro-1-(2-phenylethyl)benzene IUCrData, 2017, 2, x170547 |
| 1546723 | CIF HKL Paper | C23 H27 N9 O2 | P -1 | 7.5018; 7.6661; 21.4332 93.743; 94.776; 106.197 | 1174.52 | Sangeetha, Ramalingam; Balasubramani, Kasthuri; Thanigaimani, Kaliyaperumal; Razak, Ibrahim Abdul 6-Amino-3,4-dimethyl-1,2,4-triazin-1-ium 2-anilinobenzoate–3-amino-5,6-dimethyl-1,2,4-triazine (1/1) IUCrData, 2017, 2, x170829 |
| 1546724 | CIF Paper | C15 H9 Cl O3 | P 1 21/n 1 | 13.267; 5.105; 18.866 90; 109.67; 90 | 1203.2 | Zingales, Sarah; Padgett, Clifford 2-(4-Chlorophenyl)-3-hydroxy-4<i>H</i>-chromen-4-one IUCrData, 2017, 2, x170996 |
| 1546725 | CIF HKL | C25 H24 N2 O6 | P 1 21/c 1 | 9.4087; 15.5422; 14.6143 90; 91.077; 90 | 2136.7 | Gomathi, S.; Dravida Thendral, Era; Sivakumar, G.; Sabari, V.; Usha, G. Methyl (6<i>R</i>*,6a<i>R</i>*,12b<i>R</i>*)-2,4-dimethyl-6-(2-methylphenyl)-1,3-dioxo-2,3,4,6a,7,12b-hexahydro-1<i>H</i>,6<i>H</i>-chromeno[4',3':4,5]pyrano[2,3-<i>d</i>]pyrimidine-6a-carboxylate IUCrData, 2017, 2, x170812 |
| 1546726 | CIF HKL Paper | C28 H25 N3 O3 S | P 1 21/c 1 | 6.8521; 23.1503; 15.0422 90; 99.365; 90 | 2354.3 | Ahn, Seunghyun; Lim, Yoongho; Sung, Jiha; Koh, Dongsoo 3-(2-Hydroxy-4-methoxyphenyl)-<i>N</i>-(2-methoxyphenyl)-5-(naphthalen-1-yl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbothioamide IUCrData, 2017, 2, x170732 |
| 1546727 | CIF HKL Paper | C46 H62 Co N4 O2 | P -1 | 11.5598; 13.3787; 17.3035 111.756; 96.694; 98.293 | 2417.01 | Rani, C. Vidya; Mitu, L.; Chakkaravarthi, G.; Rajagopal, G. Bis{3,5-di-<i>tert</i>-butyl-<i>N</i>-[(4-dimethylamino)phenyl]salicylaldiminato}cobalt(II) IUCrData, 2017, 2, x170525 |
| 1546728 | CIF HKL Paper | C9 H21 N O2 | P n a 21 | 14.152; 9.8983; 15.9939 90; 90; 90 | 2240.4 | Lutter, Michael; Gock, Vinusuya; Jurkschat, Klaus The amino alcohol MeN(CH~2~CMe~2~OH)~2~ IUCrData, 2017, 2, x170799 |
| 1546729 | CIF HKL | C17 H29 N O3 | P 1 21 1 | 14.5077; 7.9149; 14.8297 90; 106.803; 90 | 1630.15 | Benharref, Amed; Ait Elhad, Mustapha; Mazoir, Noureddine; Daran, Jean-Claude; Oukhrib, Abdelouahd; Berraho, Moha (1<i>R</i>,2<i>R</i>,7<i>S</i>,8<i>R</i>,9<i>R</i>)-<i>N</i>-(2-Hydroxy-2,6,6,9-tetramethyl-12-oxatricyclo[7.2.1.0^1,7^]dodecan-8-yl)acetamide IUCrData, 2017, 2, x170970 |
| 1546730 | CIF HKL Paper | C13 H9 F13 N2 S | P -1 | 7.425; 9.952; 24.359 85.076; 83.431; 88.72 | 1781.4 | Partl, Gabriel; Laus, Gerhard; Gelbrich, Thomas; Wurst, Klaus; Huppertz, Hubert; Schottenberger, Herwig 3-(1<i>H</i>,1<i>H</i>,2<i>H</i>,2<i>H</i>-Perfluorooctyl)-1-vinyl-4-imidazoline-2-thione IUCrData, 2017, 2, x170648 |
| 1546731 | CIF HKL Paper | C16 H32 Ag2 Cl2 S4 | P -1 | 6.1921; 9.9443; 10.3761 114.71; 102.121; 92.239 | 561.66 | Liebing, Phil Di-μ-chlorido-bis[bis(tetrahydrothiophene-κ<i>S</i>)silver(I)] IUCrData, 2017, 2, x170921 |
| 1546732 | CIF HKL Paper | C11 H19 N3 S | P 21 21 21 | 12.2974; 13.7295; 14.8952 90; 90; 90 | 2514.86 | Fawzi, Mourad; Auhmani, Aziz; Ait Itto, Moulay Youssef; Riahi, Abdelkhalek; Chevreux, Sylviane; Ketatni, El Mostafa (2<i>E</i>)-<i>N</i>-Methyl-2-[1-(4-methylcyclohex-3-en-1-yl)ethylidene]hydrazinecarbothioamide IUCrData, 2017, 2, x170513 |
| 1546733 | CIF | Ag Al | R -3 m | 2.97545; 2.97545; 26.88393 90; 90; 120 | 206.124 | Zhang, Zezhong; Bourgeois, Laure; Rosalie, Julian M.; Medhekar, Nikhil V. The bi-layered precipitate phase ζ in the Al-Ag alloy system Acta Materialia, 2017, 132, 525 |
| 1546734 | CIF | C18 H19 F6 N2 O P | P 1 21/n 1 | 10.1719; 17.7909; 11.0986 90; 110.562; 90 | 1880.5 | Zhu, Haoxuan; Janusson, Eric; Luo, Jingwei; Piers, James; Islam, Farhana; McGarvey, Bryce; Oliver, Allen Grayson; Granot, Ori; McIndoe, Jason Scott Phenol-selective mass spectrometric analysis of jet fuel The Analyst, 2017 |
| 1546735 | CIF | C12 H14 Br F6 N2 P | P 21 21 21 | 8.3093; 10.675; 16.8309 90; 90; 90 | 1492.93 | Zhu, Haoxuan; Janusson, Eric; Luo, Jingwei; Piers, James; Islam, Farhana; McGarvey, Bryce; Oliver, Allen Grayson; Granot, Ori; McIndoe, Jason Scott Phenol-selective mass spectrometric analysis of jet fuel The Analyst, 2017 |
| 1546736 | CIF | C13 H11 Br N2 O3 S | P -1 | 6.9455; 8.1993; 13.825 97.886; 97.939; 109.479 | 720.8 | Aubert, Emmanuel; Espinosa, Enrique; Nicolas, Irène; Jeannin, Olivier; Fourmigué, Marc Toward a reverse hierarchy of halogen bonding between bromine and iodine Faraday Discuss., 2017 |
| 1546737 | CIF | C14 H14 Br N3 O3 S | P -1 | 7.2107; 8.5679; 12.2391 86.641; 79.084; 87.121 | 740.59 | Aubert, Emmanuel; Espinosa, Enrique; Nicolas, Irène; Jeannin, Olivier; Fourmigué, Marc Toward a reverse hierarchy of halogen bonding between bromine and iodine Faraday Discuss., 2017 |
| 1546738 | CIF | C29 H44 O3 | P 1 21 1 | 14.1074; 5.8267; 17.4282 90; 112.703; 90 | 1321.59 | Hou, Ji-Qin; Guo, Cui; Zhao, Jian-Juan; Dong, Yang-Yang; Hu, Xiao-Long; He, Qi-Wei; Zhang, Bao-Bao; Yan, Ming; Wang, Hao Anti-inflammatory Meroterpenoids from Baeckea frutescens. Journal of natural products, 2017, 80, 2204-2214 |
| 1546739 | CIF HKL Paper | C6 H7 N3 O | P 1 21/n 1 | 3.7592; 6.7317; 25.29 90; 93.106; 90 | 639 | Rillema, D. Paul; Senaratne, Nilmini K.; Moore, Curtis; KomReddy, Venugopal 5-Methylpyrazine-2-carboxamide IUCrData, 2017, 2, x171090 |
| 1546740 | CIF HKL Paper | C10 H9 N3 O2 | P 21 21 21 | 6.9549; 11.6778; 12.2165 90; 90; 90 | 992.2 | Boulhaoua, Mohammed; Essaghouani, Abdelhanine; Lahmidi, Sanae; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T. 5-Nitro-1-(prop-2-en-1-yl)-1<i>H</i>-indazole IUCrData, 2017, 2, x171091 |
| 1546741 | CIF | C28 H38 F6 N6 O4 P Ru | P 1 2/c 1 | 9.2078; 10.49143; 16.4278 90; 96.1345; 90 | 1577.89 | Li, Cai; Ip, Kwok-Wa; Man, Wai-Lun; Song, Dan; He, Ming-Liang; Yiu, Shek-Man; Lau, Tai-Chu; ZHU, Guangyu Cytotoxic (Salen)ruthenium(III) Anticancer Complexes Exhibit Different Modes of Cell Death Directed by Axial Ligands Chem. Sci., 2017 |
| 1546742 | CIF | C26 H40 F6 N8 O3 P Ru | P 1 21/n 1 | 14.1727; 16.5751; 14.5768 90; 110.762; 90 | 3201.92 | Li, Cai; Ip, Kwok-Wa; Man, Wai-Lun; Song, Dan; He, Ming-Liang; Yiu, Shek-Man; Lau, Tai-Chu; ZHU, Guangyu Cytotoxic (Salen)ruthenium(III) Anticancer Complexes Exhibit Different Modes of Cell Death Directed by Axial Ligands Chem. Sci., 2017 |
| 1546743 | CIF | C84 H136 Cl6 Li2 O10 Sc4 Si4 | P -1 | 12.1887; 12.7433; 16.8304 83.56; 75.676; 74.313 | 2435.7 | Ma, Wangyang; yu, chao; Chi, Yue; Chen, Tianyang; Wang, Lianjun; Yin, Jianhao; Wei, Baosheng; Xu, Ling; Zhang, Wen-Xiong; Xi, Zhenfeng Formation and Ligand-Based Reductivity of Bridged Bis-alkylidene Scandium(III) Complexes Chem. Sci., 2017 |
| 1546744 | CIF | C11 H22 Cl2 N O2 S2 Sc | P 1 21/n 1 | 7.6252; 17.9614; 12.5733 90; 101.302; 90 | 1688.64 | Ma, Wangyang; yu, chao; Chi, Yue; Chen, Tianyang; Wang, Lianjun; Yin, Jianhao; Wei, Baosheng; Xu, Ling; Zhang, Wen-Xiong; Xi, Zhenfeng Formation and Ligand-Based Reductivity of Bridged Bis-alkylidene Scandium(III) Complexes Chem. Sci., 2017 |
| 1546745 | CIF | C38 H60 Cl2 Li O4 Sc Si2 | P -1 | 12.597; 13.4393; 15.161 89.102; 69.72; 89.532 | 2407.3 | Ma, Wangyang; yu, chao; Chi, Yue; Chen, Tianyang; Wang, Lianjun; Yin, Jianhao; Wei, Baosheng; Xu, Ling; Zhang, Wen-Xiong; Xi, Zhenfeng Formation and Ligand-Based Reductivity of Bridged Bis-alkylidene Scandium(III) Complexes Chem. Sci., 2017 |
| 1546746 | CIF | C12 H18 Cl O2 Sc | P 1 n 1 | 7.0301; 10.1171; 9.2007 90; 101.433; 90 | 641.41 | Ma, Wangyang; yu, chao; Chi, Yue; Chen, Tianyang; Wang, Lianjun; Yin, Jianhao; Wei, Baosheng; Xu, Ling; Zhang, Wen-Xiong; Xi, Zhenfeng Formation and Ligand-Based Reductivity of Bridged Bis-alkylidene Scandium(III) Complexes Chem. Sci., 2017 |
| 1546747 | CIF HKL Paper | C13 H9 B F3 N O | C 1 c 1 | 16.4374; 6.2657; 12.5689 90; 120.523; 90 | 1115.11 | Dziuk, Błażej; Ośmiałowski, Borys; Zakrzewska, Anna; Ejsmont, Krzysztof; Zarychta, Bartosz 2,2-Difluoro-3-(4-fluorophenyl)-2<i>H</i>-benzo[<i>e</i>][1,3,2]oxazaborinin-3-ium-2-uide IUCrData, 2017, 2, x171109 |
| 1546748 | CIF HKL Paper | C8 H12 N2 O4 | P n m a | 15.8203; 6.8156; 8.7275 90; 90; 90 | 941.04 | Umarani, P.; Thiruvalluvar, A.; Ramachandra Raja, C. 4-Methoxybenzylammonium nitrate IUCrData, 2017, 2, x171114 |
| 1546749 | CIF | C71 H59 B Fe N2 O P2 | P 1 21 1 | 10.7598; 17.9842; 14.3349 90; 99.782; 90 | 2733.6 | Demmans, Karl Z.; Seo, Chris S. G.; Lough, Alan J.; Morris, Robert H. From imine to amine: an unexpected left turn. Cis-β iron(ii) PNNP′ precatalysts for the asymmetric transfer hydrogenation of acetophenone Chem. Sci., 2017 |
| 1546750 | CIF | C71 H60 B Br Fe N2 O P2 | P 1 | 11.301; 14.448; 19.278 110.941; 97.709; 101.33 | 2809.8 | Demmans, Karl Z.; Seo, Chris S. G.; Lough, Alan J.; Morris, Robert H. From imine to amine: an unexpected left turn. Cis-β iron(ii) PNNP′ precatalysts for the asymmetric transfer hydrogenation of acetophenone Chem. Sci., 2017 |
| 1546751 | CIF | C67 H70 B Br Fe N2 O2 P2 | P 21 21 21 | 10.9864; 12.9194; 40.2053 90; 90; 90 | 5706.6 | Demmans, Karl Z.; Seo, Chris S. G.; Lough, Alan J.; Morris, Robert H. From imine to amine: an unexpected left turn. Cis-β iron(ii) PNNP′ precatalysts for the asymmetric transfer hydrogenation of acetophenone Chem. Sci., 2017 |
| 1546752 | CIF | C23 H21 Br O4 | P 1 21 1 | 8.473; 10.542; 11.891 90; 106.339; 90 | 1019.2 | Ray Choudhury, Abhijnan; Manna, Madhu Sudan; Mukherjee, Santanu Nitro-enabled catalytic enantioselective formal umpolung alkenylation of β-ketoesters Chem. Sci., 2017 |
| 1546753 | CIF | C31 H30 F3 Mn N6 O9 S2 | P -1 | 10.5628; 13.4613; 26.2818 79.225; 83.349; 75.404 | 3543.33 | Reddy G., Upendar; Liu, Jingjing; Hoffmann, Patrick; Steinmetzer, Johannes; Görls, Helmar; Kupfer, Stephan; Askes, Sven H. C.; Neugebauer, Ute; Gräfe, Stefanie; Schiller, Alexander Light-responsive paper strips as CO-releasing material with a colourimetric response Chem. Sci., 2017 |
| 1546754 | CIF | C26 H32 N2 O3 | P 21 21 21 | 6.2718; 14.7186; 24.2813 90; 90; 90 | 2241.46 | Flanigan, Darrin M.; Rovis, Tomislav Enantioselective N-heterocyclic carbene-catalyzed nucleophilic dearomatization of alkyl pyridiniums Chem. Sci., 2017 |
| 1546755 | CIF | C248 H200 Br8 F8 N8 O16 | P -1 | 15.599; 18.69; 19.2605 70.341; 87.9; 67.582 | 4861.2 | Kumar, Tarun; Mane, Vaijinath; Namboothiri, Irishi N. N. Synthesis of Aminophenanthrenes and Benzoquinolines via Hauser-Kraus Annulation of Sulfonyl Phthalide with Rauhut-Currier Adducts of Nitroalkenes. Organic letters, 2017, 19, 4283-4286 |
| 1546756 | CIF | C20 H34 B N | P 1 21/n 1 | 9.4869; 16.4069; 12.2003 90; 93.931; 90 | 1894.5 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546757 | CIF | C25 H44 B N | P 1 21/n 1 | 15.483; 9.8194; 16.6483 90; 105.121; 90 | 2443.5 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546758 | CIF | C29 H44 B N | P 1 21/n 1 | 13.724; 16.513; 23.647 90; 105.61; 90 | 5161 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546759 | CIF | C40 H63 B Li N O3 | P b c a | 17.9286; 17.5371; 24.5618 90; 90; 90 | 7722.6 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546760 | CIF | C29 H53 B Li N O | P 1 21/n 1 | 9.633; 31.696; 10.432 90; 115.215; 90 | 2881.7 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546761 | CIF | C25 H39 B N2 | P b c a | 15.5756; 16.3913; 18.0729 90; 90; 90 | 4614.1 | Braunschweig, Holger; Auerhammer, Dominic; Arrowsmith, Merle; Dewhurst, Rian; JIMENEZ-HALLA, J. OSCAR C.; Kupfer, Thomas Nucleophilic Addition and Substitution at Coordinatively Saturated Boron by Facile 1,2-Hydrogen Shuttling onto a Carbene Donor Chem. Sci., 2017 |
| 1546762 | CIF | C11 H14 N2 O5 S2 | P b c a | 9.411; 14.986; 19.855 90; 90; 90 | 2800.2 | Mizojiri, Ryo; Takami, Kazuaki; Ito, Tatsuya; Maeda, Hiroyuki; Yamano, Mitsuhisa; Kawamoto, Tetsuji Efficient and Stereoselective Syntheses of Isomerically Pure 4-Aminotetrahydro-2H-thiopyran 1-Oxide Derivatives Organic Process Research & Development, 2017, 21, 1034 |
| 1546763 | CIF | C22 H10 Br2 F2 | P -1 | 8.9382; 12.8773; 14.7873 90.81; 94.233; 99.34 | 1674.3 | Ravat, Prince; Hinkelmann, Rahel; Steinebrunner, David; Prescimone, Alessandro; Bodoky, Ina; Juríček, Michal Configurational Stability of [5]Helicenes. Organic letters, 2017, 19, 3707-3710 |
| 1546764 | CIF | C15 H14 O2 Se | P 21 21 21 | 5.9869; 10.9322; 19.3709 90; 90; 90 | 1267.83 | Topinka, Michael; Zawatzky, Kerstin; Barnes, Charles L.; Welch, Christopher J.; Harmata, Michael An Asymmetric, Catalytic (4 + 3) Cycloaddition Reaction of Cyclopentenyl Oxyallylic Cations. Organic letters, 2017, 19, 4106-4109 |
| 1546765 | CIF | C27 H28 N4 O7 | P 21 21 21 | 5.5338; 16.6117; 26.533 90; 90; 90 | 2439.1 | Liao, Hongze; Leng, Wei-Lin; Le Mai Hoang, Kim; Yao, Hui; He, Jingxi; Voo, Amanda Ying Hui; Liu, Xue-Wei Asymmetric syntheses of 8-oxabicyclo[3,2,1]octane and 11-oxatricyclo[5.3.1.0]undecane from glycals Chem. Sci., 2017 |
| 1546766 | CIF | C22 H20 O4 | P 21 21 21 | 5.8597; 8.435; 35.607 90; 90; 90 | 1759.9 | Liao, Hongze; Leng, Wei-Lin; Le Mai Hoang, Kim; Yao, Hui; He, Jingxi; Voo, Amanda Ying Hui; Liu, Xue-Wei Asymmetric syntheses of 8-oxabicyclo[3,2,1]octane and 11-oxatricyclo[5.3.1.0]undecane from glycals Chem. Sci., 2017 |
| 1546767 | CIF | C36.5 H52.5 Cl1.5 Co N2 O2 | P 21 21 21 | 10.1542; 26.46; 26.744 90; 90; 90 | 7185.6 | Liu, Xu; Tian, Lei; Wu, Zhenqiang; Zhao, Xianyuan; Wang, Zikuan; Yu, Donggeng; Fu, Xuefeng Visible-light-induced synthesis of polymers with versatile end groups mediated by organocobalt complexes Polym. Chem., 2017 |
| 1546768 | CIF | C42 H56 Co N3 O4 | P -1 | 10.733; 12.501; 17.319 92.4; 104.5; 106.39 | 2142.4 | Liu, Xu; Tian, Lei; Wu, Zhenqiang; Zhao, Xianyuan; Wang, Zikuan; Yu, Donggeng; Fu, Xuefeng Visible-light-induced synthesis of polymers with versatile end groups mediated by organocobalt complexes Polym. Chem., 2017 |
| 1546769 | CIF | C40 H56 Co N3 O3 | P -1 | 10.784; 12.609; 14.442 98.614; 96.546; 105.985 | 1841.5 | Liu, Xu; Tian, Lei; Wu, Zhenqiang; Zhao, Xianyuan; Wang, Zikuan; Yu, Donggeng; Fu, Xuefeng Visible-light-induced synthesis of polymers with versatile end groups mediated by organocobalt complexes Polym. Chem., 2017 |
| 1546770 | CIF | C45 H68 Co N3 O3 | P 1 21/c 1 | 16.383; 10.7067; 23.844 90; 90.313; 90 | 4182.4 | Liu, Xu; Tian, Lei; Wu, Zhenqiang; Zhao, Xianyuan; Wang, Zikuan; Yu, Donggeng; Fu, Xuefeng Visible-light-induced synthesis of polymers with versatile end groups mediated by organocobalt complexes Polym. Chem., 2017 |
| 1546771 | CIF | C17 H13 F3 O2 S | P -1 | 6.195; 9.868; 13.376 77.035; 85.51; 89.77 | 794.3 | Sonehara, Taro; Murakami, Shogo; Yamazaki, Sae; Kawatsura, Motoi Iron-Catalyzed Intermolecular Hydrothiolation of Internal Alkynes with Thiosalicylic Acids, and Sequential Intramolecular Cyclization Reaction. Organic letters, 2017, 19, 4299-4302 |
| 1546772 | CIF HKL Paper | C12 H13 O6 P | P 1 21/c 1 | 9.9684; 7.8695; 16.6927 90; 106.097; 90 | 1258.14 | Li, Yunfei; Xiao, Yongmei; Zhang, Xinchi; Yang, Liangru; Yuan, Jinwei; Mao, Pu Dimethyl (7-hydroxy-4-methyl-2-oxo-2<i>H</i>-chromen-3-yl)phosphonate IUCrData, 2017, 2, x171119 |
| 1546773 | CIF HKL Paper | C22 H23 F3 N O3 P | P 1 21/c 1 | 13.7056; 10.6494; 14.9163 90; 91.744; 90 | 2176.12 | Jezuita, Anna; Cal, Dariusz; Zagórski, Piotr; Ejsmont, Krzysztof; Zarychta, Bartosz Diethyl (1-benzyl-4-phenyl-3-trifluoromethyl-1<i>H</i>-pyrrol-2-yl)phosphonate IUCrData, 2017, 2, x171122 |
| 1546774 | CIF HKL Paper | C19 H17 B F2 N2 O | P 1 21/n 1 | 9.6529; 17.7072; 10.4833 90; 114.106; 90 | 1635.6 | Dziuk, Błażej; Ośmiałowski, Borys; Skotnicka, Agnieszka; Ejsmont, Krzysztof; Zarychta, Bartosz 2-[4-(Dimethylamino)phenyl]-3,3-difluoro-3<i>H</i>-naphtho[1,2-<i>e</i>][1,3,2]oxazaborinin-2-ium-3-uide IUCrData, 2017, 2, x171141 |
| 1546775 | CIF | B2 Ca O8 Si2 | P n a m | 6.8576; 8.1526; 7.7457 90; 90; 90 | 433.04 | Pakhomova, Anna; Bykova, Elena; Bykov, Maxim; Glazyrin, Konstantin; Gasharova, Biliana; Liermann, Hanns-Peter; Mezouar, Mohamed; Gorelova, Liudmila; Krivovichev, Sergey; Dubrovinsky, Leonid A closer look into close packing: pentacoordinated silicon in a high-pressure polymorph of danburite IUCrJ, 2017, 4 |
| 1546776 | CIF | B2 Ca O8 Si2 | P n a m | 6.3537; 7.9518; 8.0112 90; 90; 90 | 404.75 | Pakhomova, Anna; Bykova, Elena; Bykov, Maxim; Glazyrin, Konstantin; Gasharova, Biliana; Liermann, Hanns-Peter; Mezouar, Mohamed; Gorelova, Liudmila; Krivovichev, Sergey; Dubrovinsky, Leonid A closer look into close packing: pentacoordinated silicon in a high-pressure polymorph of danburite IUCrJ, 2017, 4 |
| 1546777 | CIF | B2 Ca O8 Si2 | P -1 | 5.479; 5.532; 6.681 91.74; 104.57; 95.59 | 194.7 | Pakhomova, Anna; Bykova, Elena; Bykov, Maxim; Glazyrin, Konstantin; Gasharova, Biliana; Liermann, Hanns-Peter; Mezouar, Mohamed; Gorelova, Liudmila; Krivovichev, Sergey; Dubrovinsky, Leonid A closer look into close packing: pentacoordinated silicon in a high-pressure polymorph of danburite IUCrJ, 2017, 4 |
| 1546778 | CIF | B4 Ca2 O16 Si4 | P 1 21/c 1 | 7.9989; 7.8697; 6.249 90; 89.75; 90 | 393.4 | Pakhomova, Anna; Bykova, Elena; Bykov, Maxim; Glazyrin, Konstantin; Gasharova, Biliana; Liermann, Hanns-Peter; Mezouar, Mohamed; Gorelova, Liudmila; Krivovichev, Sergey; Dubrovinsky, Leonid A closer look into close packing: pentacoordinated silicon in a high-pressure polymorph of danburite IUCrJ, 2017, 4 |
| 1546779 | CIF | C25 H37 F O5 | P 1 | 6.6282; 12.7871; 29.3443 81.5019; 84.6748; 75.0869 | 2373.02 | Bume, Desta Doro; Pitts, Cody Ross; Ghorbani, Fereshte; Harry, Stefan Andrew; Capilato, Joseph N.; Siegler, Maxime A.; Lectka, Thomas Ketones as Directing Groups in Photocatalytic sp3 C-H Fluorination Chem. Sci., 2017 |
| 1546780 | CIF | C21 H29 F O2 | P 21 21 2 | 12.91998; 18.73733; 7.59349 90; 90; 90 | 1838.28 | Bume, Desta Doro; Pitts, Cody Ross; Ghorbani, Fereshte; Harry, Stefan Andrew; Capilato, Joseph N.; Siegler, Maxime A.; Lectka, Thomas Ketones as Directing Groups in Photocatalytic sp3 C-H Fluorination Chem. Sci., 2017 |
| 1546781 | CIF | C25 H37 F O5 | P 1 21 1 | 14.1167; 11.44999; 29.4125 90; 103.821; 90 | 4616.48 | Bume, Desta Doro; Pitts, Cody Ross; Ghorbani, Fereshte; Harry, Stefan Andrew; Capilato, Joseph N.; Siegler, Maxime A.; Lectka, Thomas Ketones as Directing Groups in Photocatalytic sp3 C-H Fluorination Chem. Sci., 2017 |
| 1546782 | CIF HKL Paper | C19 H20 N2 O5 | P 21 21 21 | 9.3432; 10.4314; 18.0901 90; 90; 90 | 1763.1 | Karai, Oumaima; Aouine, Younas; Faraj, Hassane; Alami, Anouar; El Hallaoui, Abdelilah; Zouihri, Hafid Methyl (2<i>R</i>)-2-benzamido-2-{[(1<i>R</i>)-2-methoxy-2-oxo-1-phenylethyl]amino}acetate IUCrData, 2017, 2, x171155 |
| 1546783 | CIF | C20 H17 N O0 S | P 1 21/c 1 | 11.18234; 5.96601; 23.6894 90; 94.8227; 90 | 1574.82 | Jiang, Huanfeng; Huang, Yubing; Li, Xianwei; Wang, Xu; Yu, Yue; Zheng, Jia; Wu, Wanqing Copper-Catalyzed Cyanothiolation to Incorporate Sulfur-Substituted Quaternary Carbon Center Chem. Sci., 2017 |
| 1546784 | CIF HKL | C21 H17 N O2 | P -1 | 11.1344; 12.0889; 12.4679 89.171; 79.125; 84.202 | 1639.62 | Bargavi, Srinivasan; Gouthaman, Siddan; Sugunnalakshmi, Madurai; Lakshmi, Srinivasakannan (<i>R</i>*)-1-Benzyl-3-(2-hydroxyphenyl)indoline-2-one IUCrData, 2017, 2, x171164 |
| 1546785 | CIF | C32.3 H45.6 I2 N4 O2.5 S2.2 | P -1 | 12.8533; 14.3215; 20.7096 86.942; 76.463; 83.026 | 3677.6 | Shi, Xiujuan; Yu, Chris Y. Y.; Su, Huifang; Kwok, Ryan T. K.; Jiang, Meijuan; He, Zikai; Lam, Jacky Wing Yip; Tang, Ben Zhong Red-emissive antibody-AIEgen conjugate for turn-on and wash-free imaging of specific cancer cell Chem. Sci., 2017 |
| 1546786 | CIF | C18 H6 Cu3 O12 | F m -3 m | 26.2824; 26.2824; 26.2824 90; 90; 90 | 18155 | Getzschmann, Juergen; Senkovska, Irena; Wallacher, Dirk; Tovar, Michael; Fairen-Jimenez, David; Düren, Tina; van Baten, Jasper M.; Krishna, Rajamani; Kaskel, Stefan Methane storage mechanism in the metal-organic framework Cu3(btc)2: An in situ neutron diffraction study Microporous and Mesoporous Materials, 2010, 136, 50-58 |
| 1546787 | CIF | C24.5 H6 Cu3 D26 O12 | F m -3 m | 26.2795; 26.2795; 26.2795 90; 90; 90 | 18148.9 | Getzschmann, Juergen; Senkovska, Irena; Wallacher, Dirk; Tovar, Michael; Fairen-Jimenez, David; Düren, Tina; van Baten, Jasper M.; Krishna, Rajamani; Kaskel, Stefan Methane storage mechanism in the metal-organic framework Cu3(btc)2: An in situ neutron diffraction study Microporous and Mesoporous Materials, 2010, 136, 50-58 |
| 1546788 | CIF | C29 H6 Cu3 D44 O12 | F m -3 m | 26.2765; 26.2765; 26.2765 90; 90; 90 | 18142.7 | Getzschmann, Juergen; Senkovska, Irena; Wallacher, Dirk; Tovar, Michael; Fairen-Jimenez, David; Düren, Tina; van Baten, Jasper M.; Krishna, Rajamani; Kaskel, Stefan Methane storage mechanism in the metal-organic framework Cu3(btc)2: An in situ neutron diffraction study Microporous and Mesoporous Materials, 2010, 136, 50-58 |
| 1546789 | CIF | C40 H41 B2 N | P 1 21 1 | 11.8877; 24.3685; 11.9282 90; 115.568; 90 | 3117.05 | Fingerle, Michael; Maichle-Mössmer, Cäcilia; Schundelmeier, Simon; Speiser, Bernd; Bettinger, Holger F. Synthesis and Characterization of a Boron-Nitrogen-Boron Zigzag-Edged Benzo[fg]tetracene Motif. Organic letters, 2017, 19, 4428-4431 |
| 1546790 | CIF | C25 H20 N2 O3 | P 1 21/n 1 | 9.98; 10.4842; 19.301 90; 103.22; 90 | 1965.99 | Qiu, Shaotong; Chen, Lianfen; Jiang, Huanfeng; Zhu, Shifa CuCl/Et3N-Catalyzed Synthesis of Indanone-Fused 2-Methylene Pyrrolidines from Enynals and Propargylamines. Organic letters, 2017, 19, 4540-4543 |
| 1546791 | CIF HKL Paper | C55 H45 Ag N P3 S | P 1 21/n 1 | 18.1884; 13.5886; 18.3224 90; 94.711; 90 | 4513.2 | Nimthong-Roldán, Arunpatcha; Sripa, Paramee; Romyen, Monpariya; Wattanakanjana, Yupa (Thiocyanato-κ<i>S</i>)tris(triphenylphosphane-κ<i>P</i>)silver(I) IUCrData, 2017, 2, x171185 |
| 1546792 | CIF | C13 H13 N3 O | P -1 | 6.0966; 8.7275; 11.867 98.93; 102.72; 107.148 | 571.9 | Meng, Guangrong; Lalancette, Roger; Szostak, Roman; Szostak, Michal N-Methylamino Pyrimidyl Amides (MAPA): Highly Reactive, Electronically-Activated Amides in Catalytic N-C(O) Cleavage. Organic letters, 2017, 19, 4656-4659 |
| 1546793 | CIF | C21 H20 N2 O4 | P -1 | 6.1168; 12.5792; 13.3742 113.132; 92.441; 103.376 | 910.36 | Rivilla de la Cruz, Iván; de Cózar, Abel; Schäfer, Thomas; Hernandez, Frank J.; Bittner, Alexander M.; Eleta, Aitziber; Aboudzadeh, Ali; SANTOS, JOSE IGNACIO; Miranda, José Ignacio; Cossio, Fernando Catalysis of a 1,3-dipolar reaction by distorted DNA incorporating a heterobimetallic platinum (II) and copper (II) complex Chem. Sci., 2017 |
| 1546794 | CIF | C18 H16 N2 O4 S | P 1 21/c 1 | 6.5875; 25.7074; 10.0552 90; 101.245; 90 | 1670.13 | Rivilla de la Cruz, Iván; de Cózar, Abel; Schäfer, Thomas; Hernandez, Frank J.; Bittner, Alexander M.; Eleta, Aitziber; Aboudzadeh, Ali; SANTOS, JOSE IGNACIO; Miranda, José Ignacio; Cossio, Fernando Catalysis of a 1,3-dipolar reaction by distorted DNA incorporating a heterobimetallic platinum (II) and copper (II) complex Chem. Sci., 2017 |
| 1546795 | CIF | C68 H58 N8 O8 | P 1 21/c 1 | 17.1886; 7.6152; 20.9922 90; 100.509; 90 | 2701.7 | Callaghan, Susan; Filatov, Mikhail A.; Sitte, Elisabeth; Savoie, Huguette; Boyle, Ross W.; Flanagan, Keith; Senge, Mathias O. Delayed release singlet oxygen sensitizers based on pyridone-appended porphyrins Photochem. Photobiol. Sci., 2017 |
| 1546796 | CIF | C48 H34 Br4 N4 | P 1 21/c 1 | 15.8019; 8.9658; 14.5051 90; 107.3; 90 | 1962.1 | Callaghan, Susan; Filatov, Mikhail A.; Sitte, Elisabeth; Savoie, Huguette; Boyle, Ross W.; Flanagan, Keith; Senge, Mathias O. Delayed release singlet oxygen sensitizers based on pyridone-appended porphyrins Photochem. Photobiol. Sci., 2017 |
| 1546797 | CIF | C9 H11 O | P 21 21 21 | 6.768729; 8.96849; 23.39031 90; 90; 90 | 1419.92 | James A. Kaduk; Amy M. Gindhart; Thomas N. Blanton Crystal Structure of 17alpha-Dihydroequilin, C18H22O2, from Synchrotron Powder Diffraction Data and Density Functional Theory Crystals, 2017, 7, 218 |
| 1546798 | CIF | C29 H28 N2 O6 S | P 1 21/c 1 | 12.4154; 10.9297; 19.168 90; 100.793; 90 | 2555 | Jia, Penghao; Zhang, Qinglong; Ou, Qima; Huang, You Sequential [1 + 4]- and [2 + 3]-Annulation of Prop-2-ynylsulfonium Salts: Access to Hexahydropyrrolo[3,2-b]indoles. Organic letters, 2017, 19, 4664-4667 |
| 1546799 | CIF | C16 H21 N O3 | P 65 | 12.9639; 12.9639; 14.8451 90; 90; 120 | 2160.65 | Zhang, Zhi-Jun; Nian, Yin; Zhu, Qin-Feng; Li, Xiao-Nian; Su, Jia; Wu, Xing-De; Yang, Jian; Zhao, Qin-Shi Lycoplanine A, a C16N Lycopodium Alkaloid with a 6/9/5 Tricyclic Skeleton from Lycopodium complanatum. Organic letters, 2017, 19, 4668-4671 |
| 1546800 | CIF | C12 H14 Cl N O2 | P 21 21 21 | 7.2478; 8.2707; 18.9058 90; 90; 90 | 1133.3 | Morris, Patrick J.; Moaddel, Ruin; Zanos, Panos; Moore, Curtis E.; Gould, Todd; Zarate, Jr, Carlos A; Thomas, Craig J. Synthesis and N-Methyl-d-aspartate (NMDA) Receptor Activity of Ketamine Metabolites. Organic letters, 2017, 19, 4572-4575 |
| 1546801 | CIF | C12 H17 Cl2 N O3 | P 1 21 1 | 7.4051; 8.6895; 11.7644 90; 107.588; 90 | 721.61 | Morris, Patrick J.; Moaddel, Ruin; Zanos, Panos; Moore, Curtis E.; Gould, Todd; Zarate, Jr, Carlos A; Thomas, Craig J. Synthesis and N-Methyl-d-aspartate (NMDA) Receptor Activity of Ketamine Metabolites. Organic letters, 2017, 19, 4572-4575 |
| 1546802 | CIF | C16 H15 Br N2 O4 | P 1 21/n 1 | 13.6026; 8.524; 14.8834 90; 113.044; 90 | 1588 | Lam, Shuk Mei; Wong, Wing-Tak; Chiu, Pauline An Approach to the Welwistatin Core via a Diazoketone Rearrangement-Ring Expansion Strategy. Organic letters, 2017, 19, 4468-4471 |
| 1546803 | CIF | C40 H26 Au F3 N2 | P -1 | 10.6675; 10.7859; 29.4456 87.957; 86.644; 64.109 | 3042.5 | Wong, Ben Yiu-Wing; Wong, Hok-Lai; Wong, Yi-Chun; Au, Vonika Ka-Man; Chan, Mei-Yee; Yam, Vivian Wing-Wah Multi-functional bis(alkynyl)gold(iii) N⁁C complexes with distinct mechanochromic luminescence and electroluminescence properties Chem. Sci., 2017 |
| 1546804 | CIF | C72 H66 Ag5 B4 F22 N18 P5 | P -1 | 14.3371; 14.4204; 22.4241 84.045; 87.761; 69.157 | 4309.3 | Artem'ev, Alexander V.; Bagryanskaya, Irina Yu.; Doronina, Evgeniya P.; Tolstoy, Peter M.; Gushchin, Artem L.; Rakhmanova, Mariana I.; Ivanov, Alexander Yu.; Suturina, Anastasiya O. A new family of clusters containing a silver-centered tetracapped [Ag@Ag <sub>4</sub> (μ <sub>3</sub> -P) <sub>4</sub> ] tetrahedron, inscribed within a N <sub>12</sub> icosahedron Dalton Transactions, 2017, 46, 12425-12429 |
| 1546805 | CIF | C62 H51 Ag5 F30 N13 P9 | P 1 21/n 1 | 18.482; 22.8; 24.67 90; 96.39; 90 | 10331 | Artem'ev, Alexander V.; Bagryanskaya, Irina Yu.; Doronina, Evgeniya P.; Tolstoy, Peter M.; Gushchin, Artem L.; Rakhmanova, Mariana I.; Ivanov, Alexander Yu.; Suturina, Anastasiya O. A new family of clusters containing a silver-centered tetracapped [Ag@Ag <sub>4</sub> (μ <sub>3</sub> -P) <sub>4</sub> ] tetrahedron, inscribed within a N <sub>12</sub> icosahedron Dalton Transactions, 2017, 46, 12425-12429 |
| 1546806 | CIF | C72 H69 Ag5 B5 F20 N15 O2 P4 | P 1 21/n 1 | 23.685; 22.865; 30.599 90; 90.97; 90 | 16569 | Artem'ev, Alexander V.; Bagryanskaya, Irina Yu.; Doronina, Evgeniya P.; Tolstoy, Peter M.; Gushchin, Artem L.; Rakhmanova, Mariana I.; Ivanov, Alexander Yu.; Suturina, Anastasiya O. A new family of clusters containing a silver-centered tetracapped [Ag@Ag <sub>4</sub> (μ <sub>3</sub> -P) <sub>4</sub> ] tetrahedron, inscribed within a N <sub>12</sub> icosahedron Dalton Transactions, 2017, 46, 12425-12429 |
| 1546807 | CIF | C83 H83 Ag5 F15 N12 O21 P4 S5 | P 1 21/n 1 | 16.4246; 22.9762; 28.4848 90; 105.155; 90 | 10375.6 | Artem'ev, Alexander V.; Bagryanskaya, Irina Yu.; Doronina, Evgeniya P.; Tolstoy, Peter M.; Gushchin, Artem L.; Rakhmanova, Mariana I.; Ivanov, Alexander Yu.; Suturina, Anastasiya O. A new family of clusters containing a silver-centered tetracapped [Ag@Ag <sub>4</sub> (μ <sub>3</sub> -P) <sub>4</sub> ] tetrahedron, inscribed within a N <sub>12</sub> icosahedron Dalton Transactions, 2017, 46, 12425-12429 |
| 1546808 | CIF | C68 H58 B2 F8 Fe4 N14 O16 | P b c a | 16.7707; 28.016; 29.924 90; 90; 90 | 14060 | Hossain, Sayed Muktar; Lakma, Avinash; Pradhan, Rabindra Nath; Demeshko, Serhiy; Singh, Akhilesh Kumar Valence directed binding mode of [2 × 2] iron grids of an unsymmetrical picolinic hydrazone based ligand Dalton Transactions, 2017, 46, 12612-12618 |
| 1546809 | CIF | C60 H40 Fe4 N12 O16 | P -4 21 c | 15.0581; 15.0581; 12.1751 90; 90; 90 | 2760.7 | Hossain, Sayed Muktar; Lakma, Avinash; Pradhan, Rabindra Nath; Demeshko, Serhiy; Singh, Akhilesh Kumar Valence directed binding mode of [2 × 2] iron grids of an unsymmetrical picolinic hydrazone based ligand Dalton Transactions, 2017, 46, 12612-12618 |
| 1546810 | CIF | C26 H17 Cl O1.5 P | I 41/a :2 | 14.084; 14.084; 39.7 90; 90; 90 | 7875 | Li, Jie; Zhang, Wen-Wen; Wei, Xiao-Jing; Hao, Wen-Juan; Li, Guigen; Tu, Shu-Jiang; Jiang, Bo Synthesis of Tribenzo[b,e,g]phosphindole Oxides via Radical Bicyclization Cascades of o-Arylalkynylanilines. Organic letters, 2017, 19, 4512-4515 |
| 1546811 | CIF | C48 H44 Fe2 N2 O8 | P -1 | 10.0781; 12.2736; 18.584 74.2212; 75.854; 70.4236 | 2054.25 | Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides Catalysis Science & Technology, 2017, 7, 4375-4387 |
| 1546812 | CIF | C20 H17 N O3 | P 1 21/c 1 | 15.0129; 6.7964; 16.6082 90; 107.336; 90 | 1617.62 | Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides Catalysis Science & Technology, 2017, 7, 4375-4387 |
| 1546813 | CIF | C24 H24 N2 O6 | C 1 2/c 1 | 17.9282; 11.5903; 21.7086 90; 94.633; 90 | 4496.2 | Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides Catalysis Science & Technology, 2017, 7, 4375-4387 |
| 1546814 | CIF | C58 H44 Fe2 N4 O10 | P 1 21/n 1 | 8.639; 28.5416; 10.0003 90; 98.528; 90 | 2438.52 | Sinha, Indranil; Lee, Yuseop; Bae, Choongman; Tussupbayev, Samat; Lee, Yujin; Seo, Min-Seob; Kim, Jin; Baik, Mu-Hyun; Lee, Yunho; Kim, Hyunwoo Computer-aided rational design of Fe( <scp>iii</scp> )-catalysts for the selective formation of cyclic carbonates from CO <sub>2</sub> and internal epoxides Catalysis Science & Technology, 2017, 7, 4375-4387 |
| 1546815 | CIF | C34 H48 Cl Ir N2 Si | P 1 21/c 1 | 11.5766; 17.2082; 17.1087 90; 107.784; 90 | 3245.4 | Cabeza, Javier A.; García-Álvarez, Pablo; González-Álvarez, Laura Facile cyclometallation of a mesitylsilylene: synthesis and preliminary catalytic activity of iridium(III) and iridium(V) iridasilacyclopentenes Chemical Communications, 2017, 53, 10275-10278 |
| 1546816 | CIF | C51 H74 Cl7 Ir N4 Si2 | P -1 | 10.0773; 13.0942; 22.7288 83.648; 87.998; 76.732 | 2901.04 | Cabeza, Javier A.; García-Álvarez, Pablo; González-Álvarez, Laura Facile cyclometallation of a mesitylsilylene: synthesis and preliminary catalytic activity of iridium(III) and iridium(V) iridasilacyclopentenes Chemical Communications, 2017, 53, 10275-10278 |
| 1546817 | CIF | C35.5 H50 Cl Ir N2 Si | P 1 21/c 1 | 20.2028; 9.0196; 20.2302 90; 114.903; 90 | 3343.6 | Cabeza, Javier A.; García-Álvarez, Pablo; González-Álvarez, Laura Facile cyclometallation of a mesitylsilylene: synthesis and preliminary catalytic activity of iridium(III) and iridium(V) iridasilacyclopentenes Chemical Communications, 2017, 53, 10275-10278 |
| 1546818 | CIF | C37 H22 F3 Fe I4 N5 O2 | P 1 c 1 | 8.447; 11.738; 19.66 90; 107.207; 90 | 1862.1 | Jeon, Ie-Rang; Mathonière, Corine; Clérac, Rodolphe; Rouzières, Mathieu; Jeannin, Olivier; Trzop, Elzbieta; Collet, Eric; Fourmigué, Marc Photoinduced reversible spin-state switching of an Fe <sup>III</sup> complex assisted by a halogen-bonded supramolecular network Chemical Communications, 2017, 53, 10283-10286 |
| 1546819 | CIF | C38 H22 F3 Fe I4 N4 O2 | P 1 c 1 | 8.3692; 11.5822; 19.5061 90; 106.785; 90 | 1810.24 | Jeon, Ie-Rang; Mathonière, Corine; Clérac, Rodolphe; Rouzières, Mathieu; Jeannin, Olivier; Trzop, Elzbieta; Collet, Eric; Fourmigué, Marc Photoinduced reversible spin-state switching of an Fe <sup>III</sup> complex assisted by a halogen-bonded supramolecular network Chemical Communications, 2017, 53, 10283-10286 |
| 1546820 | CIF | C38 H22 F3 Fe I4 N4 O2 | C 1 c 1 | 16.7237; 22.9833; 19.4485 90; 107.484; 90 | 7129.98 | Jeon, Ie-Rang; Mathonière, Corine; Clérac, Rodolphe; Rouzières, Mathieu; Jeannin, Olivier; Trzop, Elzbieta; Collet, Eric; Fourmigué, Marc Photoinduced reversible spin-state switching of an Fe <sup>III</sup> complex assisted by a halogen-bonded supramolecular network Chemical Communications, 2017, 53, 10283-10286 |
| 1546821 | CIF | C80 H154 Br6 Cu N8 O5 | P -1 | 9.4175; 17.1528; 28.9801 79.223; 89.723; 82.329 | 4556.6 | Yao, Junyao; Chen, Qibin; Sheng, Yujie; Kai, Aiting; Liu, Honglai pH-controlled crystal growth of copper/gemini surfactant complexes with bipyridine groups CrystEngComm, 2017, 19, 5835-5843 |
| 1546822 | CIF | C80 H166 Br6 Cu2 N8 O12 | P 1 21/c 1 | 30.2435; 9.4252; 18.2742 90; 107.545; 90 | 4966.76 | Yao, Junyao; Chen, Qibin; Sheng, Yujie; Kai, Aiting; Liu, Honglai pH-controlled crystal growth of copper/gemini surfactant complexes with bipyridine groups CrystEngComm, 2017, 19, 5835-5843 |
| 1546823 | CIF | C19 H29 Cl2 Ir N2 O2 | P 1 21/c 1 | 11.7603; 12.1239; 15.2286 90; 91.3973; 90 | 2170.7 | Takahashi, Hiroyuki; Kodama, Shintaro; Ishii, Youichi Direct transformation of 2-acetylpyridine oxime esters into α-oxygenated imines in an Ir( <scp>iii</scp> ) complex Dalton Transactions, 2017, 46, 12032-12035 |
| 1546824 | CIF | C19 H25 B Cl F4 Ir N2 O2 | P 21 21 21 | 7.543; 12.7445; 22.732 90; 90; 90 | 2185.3 | Takahashi, Hiroyuki; Kodama, Shintaro; Ishii, Youichi Direct transformation of 2-acetylpyridine oxime esters into α-oxygenated imines in an Ir( <scp>iii</scp> ) complex Dalton Transactions, 2017, 46, 12032-12035 |
| 1546825 | CIF | C78 H52 B F24 Ir N2 P2 | P 1 21/c 1 | 17.7616; 18.096; 25.5666 90; 109.065; 90 | 7766.7 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546826 | CIF | C81 H59 B F24 Ir N2 P2 | P -1 | 17.3484; 17.38548; 29.3494 81.8139; 77.513; 62.9306 | 7686.07 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546827 | CIF | C78 H52 B F24 N2 P2 Rh | C 1 2 1 | 25.683; 8.80488; 22.6553 90; 135.53; 90 | 3589 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546828 | CIF | C68 H47 B F24 Ir N2 P | P 1 21/c 1 | 12.8095; 24.9098; 19.7755 90; 100.243; 90 | 6209.45 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546829 | CIF | C142 H98 B2 F48 P4 Rh2 | P -1 | 13.2601; 14.7604; 18.6577 105.777; 101.193; 103.196 | 3291.04 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546830 | CIF | C150 H122 B2 F48 Ir N3 O8 P2 | P -1 | 16.6021; 18.6428; 28.5944 75.55; 84.8989; 65.815 | 7817.1 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546831 | CIF | C68 H47 B F24 N2 P Rh | P 1 21/c 1 | 12.7985; 24.8791; 19.8716 90; 99.467; 90 | 6241.2 | Emerson-King, Jack; Knighton, Richard C.; Gyton, Matthew R.; Chaplin, Adrian B. Rotaxane synthesis exploiting the M( <scp>i</scp> )/M( <scp>iii</scp> ) redox couple Dalton Transactions, 2017, 46, 11645-11655 |
| 1546832 | CIF | C24 H23 N O4 | P 1 21/c 1 | 8.6241; 12.8186; 18.8093 90; 94.972; 90 | 2071.52 | Luo, Wenjun; Hu, Haiwen; Nian, Sanfei; Qi, Liang; Ling, Fei; Zhong, Weihui Phosphine-catalyzed [3 + 2] annulation reaction: highly regio- and diastereoselective synthesis of 2-azaspiro[4.4]nonene-1,3-diones Organic & Biomolecular Chemistry, 2017, 15, 7523-7526 |
| 1546833 | CIF | C25 H24 N2 O3 S | P 1 21/c 1 | 11.8841; 15.7939; 24.186 90; 92.407; 90 | 4535.6 | Meng, Jiang; Jia, Renmeng; Leng, Jiaying; Wen, Min; Yu, Xingxin; Deng, Wei-Ping Carbon-Carbon Bond Formation by Reaction of Rhodium Azavinylcarbenes with Secondary Amides: Access to Indigo Analogues from Isatins. Organic letters, 2017, 19, 4520-4523 |
| 1546834 | CIF | C12 H6 Hf3 O16 | F d -3 m | 34.9801; 34.9801; 34.9801 90; 90; 90 | 42802 | Nguyen, Linh H. T.; Nguyen, The T.; Nguyen, Ha L.; Doan, Tan L. H.; Tran, Phuong Hoang A new superacid hafnium-based metal–organic framework as a highly active heterogeneous catalyst for the synthesis of benzoxazoles under solvent-free conditions Catalysis Science & Technology, 2017, 7, 4346-4350 |
| 1546835 | CIF | C9 H3 Hf3 O13 S6 | F d -3 m | 34.901; 34.901; 34.901 90; 90; 90 | 42512 | Nguyen, Linh H. T.; Nguyen, The T.; Nguyen, Ha L.; Doan, Tan L. H.; Tran, Phuong Hoang A new superacid hafnium-based metal–organic framework as a highly active heterogeneous catalyst for the synthesis of benzoxazoles under solvent-free conditions Catalysis Science & Technology, 2017, 7, 4346-4350 |
| 1546836 | CIF | C0 H18 B69 Mg7 N0 O126 | P -3 1 c | 26.1715; 26.1715; 15.3862 90; 90; 120 | 9126.81 | Wang, Jia-Jia; Yang, Guo-Yu A novel supramolecular magnesoborate framework with snowflake-like channels built by unprecedented huge B <sub>69</sub> cluster cages Chemical Communications, 2017, 53, 10398-10401 |
| 1546837 | CIF | C18 H6 S3 | P 1 21 1 | 9.785; 7.3055; 9.929 90; 118.84; 90 | 621.7 | Tan, Qitao; Zhou, Dandan; Zhang, Tao; Liu, Bingxin; Xu, Bin Iodine-doped sumanene and its application for the synthesis of chalcogenasumanenes and silasumanenes Chemical Communications, 2017, 53, 10279-10282 |
| 1546838 | CIF | C24 H24 Si3 | P 1 21/c 1 | 12.04; 20.685; 18.893 90; 93.345; 90 | 4697.2 | Tan, Qitao; Zhou, Dandan; Zhang, Tao; Liu, Bingxin; Xu, Bin Iodine-doped sumanene and its application for the synthesis of chalcogenasumanenes and silasumanenes Chemical Communications, 2017, 53, 10279-10282 |
| 1546839 | CIF | C20.5 H14 N5.5 O9.5 S2 Zn2 | P 43 21 2 | 19.3615; 19.3615; 14.1645 90; 90; 90 | 5309.81 | Han, Xiao; Cheng, Qing; Meng, Xiangru; Shao, Zhichao; Ma, Ke; Wei, Donghui; Ding, Jie; Hou, Hongwei Unique structural micro-adjustments in a new benzothiadiazole-derived Zn( <scp>ii</scp> ) metal organic framework via simple photochemical decarboxylation Chemical Communications, 2017, 53, 10314-10317 |
| 1546840 | CIF | C20.5 H14 N5.5 O9.5 S2 Zn2 | P 43 21 2 | 19.3938; 19.3938; 14.1496 90; 90; 90 | 5321.94 | Han, Xiao; Cheng, Qing; Meng, Xiangru; Shao, Zhichao; Ma, Ke; Wei, Donghui; Ding, Jie; Hou, Hongwei Unique structural micro-adjustments in a new benzothiadiazole-derived Zn( <scp>ii</scp> ) metal organic framework via simple photochemical decarboxylation Chemical Communications, 2017, 53, 10314-10317 |
| 1546841 | CIF | C20.5 H14 N5.5 O9.5 S2 Zn2 | P 43 21 2 | 19.3596; 19.3596; 14.1336 90; 90; 90 | 5297.2 | Han, Xiao; Cheng, Qing; Meng, Xiangru; Shao, Zhichao; Ma, Ke; Wei, Donghui; Ding, Jie; Hou, Hongwei Unique structural micro-adjustments in a new benzothiadiazole-derived Zn( <scp>ii</scp> ) metal organic framework via simple photochemical decarboxylation Chemical Communications, 2017, 53, 10314-10317 |
| 1546842 | CIF | C24 H20 N2 O6 | P n a 21 | 28.9068; 7.9025; 8.9889 90; 90; 90 | 2053.39 | Preindl, Johannes; Chakrabarty, Shyamal; Waser, Jérôme Dearomatization of electron poor six-membered N-heterocycles through [3 + 2] annulation with aminocyclopropanes Chemical Science, 2017, 8, 7112-7118 |
| 1546843 | CIF | C14 H13 N O6 Zn | P -1 | 8.233; 9.737; 10.4837 107.355; 101.071; 111.799 | 699.98 | Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties CrystEngComm, 2017, 19, 5755-5763 |
| 1546844 | CIF | C28 H24 Cl2 Mn3 N2 O11 | P b c a | 18.019; 7.671; 23.088 90; 90; 90 | 3191.3 | Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties CrystEngComm, 2017, 19, 5755-5763 |
| 1546845 | CIF | C28 H22 N4 Ni3 O16 | P 1 2/c 1 | 8.0042; 11.5133; 17.4969 90; 114.231; 90 | 1470.37 | Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties CrystEngComm, 2017, 19, 5755-5763 |
| 1546846 | CIF | C28 H22 Co3 N4 O16 | C 1 2/c 1 | 18.151; 11.5168; 15.9081 90; 117.996; 90 | 2936.3 | Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties CrystEngComm, 2017, 19, 5755-5763 |
| 1546847 | CIF | C32 H20 Cd Cl2 N8 O9 | C 1 2/c 1 | 26.783; 10.9091; 28.532 90; 145.631; 90 | 4706.1 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546848 | CIF | C16 H10 N6 O7 Zn | P b c a | 7.8558; 13.5861; 31.5006 90; 90; 90 | 3362 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546849 | CIF | C128 H80 Cu8 N48 O56 | P b c a | 7.838; 13.665; 30.941 90; 90; 90 | 3314 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546850 | CIF | C17 H11 Cd Cl3 N6 O7 | P 1 21/n 1 | 9.5455; 13.8394; 17.274 90; 102.492; 90 | 2227.94 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546851 | CIF | C16 H10 Cd N6 O7 | P 1 21/c 1 | 17.3051; 8.1682; 12.9742 90; 108.332; 90 | 1740.85 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546852 | CIF | C32 H20 Cl2 Cu N8 O10 | R -3 | 30.6123; 30.6123; 29.4707 90; 90; 120 | 23917.3 | Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties CrystEngComm, 2017, 19, 5864-5872 |
| 1546853 | CIF | C33 H25 F6 Ir N7 P | P 1 21/c 1 | 8.4719; 18.6483; 41.05 90; 93.604; 90 | 6472.5 | Fiorini, Valentina; Zanoni, Ilaria; Zacchini, Stefano; Costa, Anna Luisa; Hochkoeppler, Alejandro; Zanotti, Valerio; Ranieri, Anna Maria; Massi, Massimiliano; Stefan, Alessandra; Stagni, Stefano Methylation of Ir( <scp>iii</scp> )-tetrazolato complexes: an effective route to modulate the emission outputs and to switch to antimicrobial properties Dalton Transactions, 2017, 46, 12328-12338 |
| 1546854 | CIF | C31 H23 Cl4 F10 Ir N7 P | P 1 21/c 1 | 16.992; 11.9864; 17.811 90; 96.203; 90 | 3606.4 | Fiorini, Valentina; Zanoni, Ilaria; Zacchini, Stefano; Costa, Anna Luisa; Hochkoeppler, Alejandro; Zanotti, Valerio; Ranieri, Anna Maria; Massi, Massimiliano; Stefan, Alessandra; Stagni, Stefano Methylation of Ir( <scp>iii</scp> )-tetrazolato complexes: an effective route to modulate the emission outputs and to switch to antimicrobial properties Dalton Transactions, 2017, 46, 12328-12338 |
| 1546855 | CIF | C38 H31 Ir N10 | P 1 21/n 1 | 10.1798; 21.5492; 15.7661 90; 98.325; 90 | 3422.1 | Fiorini, Valentina; Zanoni, Ilaria; Zacchini, Stefano; Costa, Anna Luisa; Hochkoeppler, Alejandro; Zanotti, Valerio; Ranieri, Anna Maria; Massi, Massimiliano; Stefan, Alessandra; Stagni, Stefano Methylation of Ir( <scp>iii</scp> )-tetrazolato complexes: an effective route to modulate the emission outputs and to switch to antimicrobial properties Dalton Transactions, 2017, 46, 12328-12338 |
| 1546856 | CIF | C86 H118 N6 O24 Ti6 | C 1 2/c 1 | 23.6329; 16.0739; 27.4246 90; 112.38; 90 | 9633.2 | Lv, Hai-Ting; Cui, Ying; Zhang, Yu-Min; Li, Hua-Min; Zou, Guo-Dong; Duan, Rui-Huan; Cao, Jun-Tao; Jing, Qiang-Shan; Fan, Yang A 4-dimethylaminobenzoate-functionalized Ti <sub>6</sub> -oxo cluster with a narrow band gap and enhanced photoelectrochemical activity: a combined experimental and computational study Dalton Transactions, 2017, 46, 12313-12319 |
| 1546857 | CIF | C52 H110 O25 Ti6 | C 1 2/c 1 | 23.3256; 19.2083; 18.3696 90; 110.276; 90 | 7720.4 | Lv, Hai-Ting; Cui, Ying; Zhang, Yu-Min; Li, Hua-Min; Zou, Guo-Dong; Duan, Rui-Huan; Cao, Jun-Tao; Jing, Qiang-Shan; Fan, Yang A 4-dimethylaminobenzoate-functionalized Ti <sub>6</sub> -oxo cluster with a narrow band gap and enhanced photoelectrochemical activity: a combined experimental and computational study Dalton Transactions, 2017, 46, 12313-12319 |
| 1546858 | CIF | C84 H132 O24 Ti6 | P 1 21/n 1 | 15.6777; 16.488; 18.4096 90; 103.72; 90 | 4623 | Lv, Hai-Ting; Cui, Ying; Zhang, Yu-Min; Li, Hua-Min; Zou, Guo-Dong; Duan, Rui-Huan; Cao, Jun-Tao; Jing, Qiang-Shan; Fan, Yang A 4-dimethylaminobenzoate-functionalized Ti <sub>6</sub> -oxo cluster with a narrow band gap and enhanced photoelectrochemical activity: a combined experimental and computational study Dalton Transactions, 2017, 46, 12313-12319 |
| 1546859 | CIF | C4 H8 Ag I2 N | C 1 2/m 1 | 14.8097; 7.5317; 9.9117 90; 123.617; 90 | 920.67 | Liu, Guang-Ning; Zhang, Xu; Wang, Hong-Mei; Xu, Hong; Wang, Zi-Han; Meng, Xiang-Long; Dong, Ya-Nan; Zhao, Ruo-Yu; Li, Cuncheng Do alkyl groups on aromatic or aliphatic structure directing agents affect water stabilities and properties of hybrid iodoargentates? Dalton Transactions, 2017, 46, 12474-12486 |
| 1546860 | CIF | C20 H20 Ag3 I4 P | P 1 21/c 1 | 12.8812; 25.6384; 8.4883 90; 108.577; 90 | 2657.2 | Liu, Guang-Ning; Zhang, Xu; Wang, Hong-Mei; Xu, Hong; Wang, Zi-Han; Meng, Xiang-Long; Dong, Ya-Nan; Zhao, Ruo-Yu; Li, Cuncheng Do alkyl groups on aromatic or aliphatic structure directing agents affect water stabilities and properties of hybrid iodoargentates? Dalton Transactions, 2017, 46, 12474-12486 |
| 1546861 | CIF | C21 H22 Ag3 I4 P | P 1 21/c 1 | 13.1581; 25.7903; 8.5598 90; 108.903; 90 | 2748.1 | Liu, Guang-Ning; Zhang, Xu; Wang, Hong-Mei; Xu, Hong; Wang, Zi-Han; Meng, Xiang-Long; Dong, Ya-Nan; Zhao, Ruo-Yu; Li, Cuncheng Do alkyl groups on aromatic or aliphatic structure directing agents affect water stabilities and properties of hybrid iodoargentates? Dalton Transactions, 2017, 46, 12474-12486 |
| 1546862 | CIF | C21 H22 Ag5 I6 P | P 1 21/c 1 | 14.977; 27.1022; 7.9818 90; 97.423; 90 | 3212.7 | Liu, Guang-Ning; Zhang, Xu; Wang, Hong-Mei; Xu, Hong; Wang, Zi-Han; Meng, Xiang-Long; Dong, Ya-Nan; Zhao, Ruo-Yu; Li, Cuncheng Do alkyl groups on aromatic or aliphatic structure directing agents affect water stabilities and properties of hybrid iodoargentates? Dalton Transactions, 2017, 46, 12474-12486 |
| 1546863 | CIF | C12 H40 Ag2 I8 N6 O2 | P 1 21/c 1 | 9.2674; 12.5749; 14.8451 90; 99.039; 90 | 1708.51 | Liu, Guang-Ning; Zhang, Xu; Wang, Hong-Mei; Xu, Hong; Wang, Zi-Han; Meng, Xiang-Long; Dong, Ya-Nan; Zhao, Ruo-Yu; Li, Cuncheng Do alkyl groups on aromatic or aliphatic structure directing agents affect water stabilities and properties of hybrid iodoargentates? Dalton Transactions, 2017, 46, 12474-12486 |
| 1546864 | CIF | C52 H66 Hg3 I8 N8 O8 | C 1 2/c 1 | 16.055; 20.351; 22.103 90; 96.976; 90 | 7168 | Huang, Yong-Qing; Zhao, Yue; Wang, Peng; Okamura, Taka-aki; Laforteza, Brian N.; Lu, Yi; Sun, Wei-Yin; Yu, Jin-Quan One-pot synthesis of imidazolinium salts via the ring opening of tetrahydrofuran Dalton Transactions, 2017, 46, 12430-12433 |
| 1546865 | CIF | F8 Fe2 Li5 O4 P | P c c a | 18.835; 9.183; 9.479 90; 90; 90 | 1639.5 | Yaghoobnejad Asl, Hooman; Ghosh, Kartik; Choudhury, Amitava A highly fluorinated lithium iron phosphate with interpenetrating lattices: electrochemistry and ionic conductivity Dalton Transactions, 2017, 46, 12588-12596 |
| 1546866 | CIF | C31 H24 Dy F15 N2 Ni O12 | P 1 21/c 1 | 18.2854; 12.6822; 16.6662 90; 97.946; 90 | 3827.8 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546867 | CIF | C48 H58 N4 Ni2 O22 Yb2 | P 1 21/c 1 | 12.856; 14.164; 17.346 90; 92.55; 90 | 3155.4 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546868 | CIF | C48 H58 N4 Ni2 O22 Tm2 | P 1 21/c 1 | 12.97; 14.473; 17.537 90; 90.72; 90 | 3291.7 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546869 | CIF | C66 H57 Cl4 N2 Ni O11 Tb | P -1 | 11.289; 12.7006; 23.3948 82.054; 83.489; 76.859 | 3223.38 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546870 | CIF | C48 H58 Ho2 N4 Ni2 O22 | P 1 21/c 1 | 12.906; 14.263; 17.352 90; 92.13; 90 | 3191.9 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546871 | CIF | C48 H58 N4 Ni2 O22 Tb2 | P 1 21/c 1 | 12.95; 14.299; 17.45 90; 91.61; 90 | 3230 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546872 | CIF | C48 H58 Dy2 N4 Ni2 O22 | P 1 21/c 1 | 12.869; 14.249; 17.379 90; 92.38; 90 | 3184 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546873 | CIF | C31 H24 F15 Gd N2 Ni O12 | P 1 21/c 1 | 18.293; 12.677; 16.658 90; 97.715; 90 | 3828 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546874 | CIF | C66 H60 Cl4 Gd N2 Ni O11 | P -1 | 11.2556; 12.667; 23.339 82.268; 83.837; 77.065 | 3203.3 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546875 | CIF | C31 H24 Eu F15 N2 Ni O12 | P 1 21/c 1 | 18.242; 12.6901; 16.631 90; 97.744; 90 | 3814.8 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546876 | CIF | C66 H57 Cl4 Eu N2 Ni O11 | P -1 | 11.2622; 12.6894; 23.49 81.784; 83.709; 76.878 | 3225.4 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546877 | CIF | C66 H57 Cl4 Ho N2 Ni O11 | P -1 | 11.277; 12.697; 23.3931 81.822; 83.284; 76.675 | 3213.9 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546878 | CIF | C48 H58 Er2 N4 Ni2 O22 | P 1 21/c 1 | 12.8413; 14.1659; 17.3158 90; 92.402; 90 | 3147.12 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546879 | CIF | C31 H24 F15 N2 Ni O12 Tb | P 1 21/c 1 | 18.232; 12.6716; 16.639 90; 97.967; 90 | 3807 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546880 | CIF | C31 H24 F15 N2 Ni O12 Tb | P 1 21/c 1 | 18.2854; 12.6822; 16.6662 90; 97.946; 90 | 3827.8 | Jiang, Lin; Liu, Yue; Liu, Xin; Tian, Jinlei; Yan, Shiping Three series of heterometallic Ni <sup>II</sup> –Ln <sup>III</sup> Schiff base complexes: synthesis, crystal structures and magnetic characterization Dalton Transactions, 2017, 46, 12558-12573 |
| 1546881 | CIF | Ag3 I3 Mo2 O12 | P n a 21 | 8.0072; 21.2678; 7.3241 90; 90; 90 | 1247.26 | Meng, Chang-Yu; Zhang, Pei; Wang, Rong-Fang; Geng, Lei Ag <sub>3</sub> I[(MoO <sub>3</sub> ) <sub>2</sub> (IO <sub>3</sub> ) <sub>2</sub> ]: a new polar material synthesized from the structural modulation of molybdenyl iodate architectures by polarizable cation (Ag <sup>+</sup> ) and anion (I <sup>−</sup> ) Dalton Transactions, 2017, 46, 12320-12327 |
| 1546882 | CIF | B2 Cs Na4 O13 P3 | P n a 21 | 24.5034; 6.7673; 14.7803 90; 90; 90 | 2450.9 | Wu, Chao; Li, Longhua; Yang, Gang; Song, Junling; Yan, Bing; Humphrey, Mark G.; Zhang, Long; Shao, Jianda; Zhang, Chi Low-temperature-flux syntheses of ultraviolet-transparent borophosphates Na <sub>4</sub> MB <sub>2</sub> P <sub>3</sub> O <sub>13</sub> (M = Rb, Cs) exhibiting a second-harmonic generation response Dalton Transactions, 2017, 46, 12605-12611 |
| 1546883 | CIF | B2 Na4 O13 P3 Rb | P n a 21 | 24.0348; 6.7464; 14.9206 90; 90; 90 | 2419.35 | Wu, Chao; Li, Longhua; Yang, Gang; Song, Junling; Yan, Bing; Humphrey, Mark G.; Zhang, Long; Shao, Jianda; Zhang, Chi Low-temperature-flux syntheses of ultraviolet-transparent borophosphates Na <sub>4</sub> MB <sub>2</sub> P <sub>3</sub> O <sub>13</sub> (M = Rb, Cs) exhibiting a second-harmonic generation response Dalton Transactions, 2017, 46, 12605-12611 |
| 1546884 | CIF | C156 H194 B4 Fe Ge4 N12 | P -1 | 10.8838; 16.8256; 19.8906 77.578; 78.671; 72.523 | 3358.9 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546885 | CIF | C56 H82 B2 Ge2 N6 | P 1 21/c 1 | 11.1579; 19.2531; 27.69 90; 110.45; 90 | 5573.6 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546886 | CIF | C68 H92 B2 Fe Ge2 N6 | P -1 | 10.759; 14.972; 21.213 75.454; 78.047; 85.108 | 3233.8 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546887 | CIF | C56 H74 B2 Fe Ge2 N6 | C 1 2/c 1 | 52.0662; 10.3231; 21.2294 90; 112.682; 90 | 10528 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546888 | CIF | C58 H74 B2 Ge2 N6 | P 1 21/c 1 | 19.659; 10.841; 28.649 90; 114.791; 90 | 5543.1 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546889 | CIF | C48 H70 B2 Ge2 N6 | P 1 21/c 1 | 10.164; 21.9981; 23.169 90; 112.354; 90 | 4791 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546890 | CIF | C52 H70 B2 Ge2 N6 | P -1 | 15.39; 18.312; 36.856 91.094; 97.193; 91.257 | 10300.1 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546891 | CIF | C63 H81 B2 Ge2 N6 | P 1 21/c 1 | 22.5261; 13.268; 21.209 90; 112.06; 90 | 5874.8 | Böserle, Jiří; Zhigulin, Grigory; Štěpnička, Petr; Horký, Filip; Erben, Milan; Jambor, Roman; R°užička, Aleš; Ketkov, Sergey; Dostál, Libor Facile activation of alkynes with a boraguanidinato-stabilized germylene: a combined experimental and theoretical study Dalton Transactions, 2017, 46, 12339-12353 |
| 1546892 | CIF | C20 H20 Gd N O10 | C 1 2/c 1 | 16.2952; 14.3563; 9.5659 90; 92.861; 90 | 2235 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546893 | CIF | C20 H20 N O10 Y | C 1 2/c 1 | 16.281; 14.373; 9.581 90; 93.334; 90 | 2238.2 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546894 | CIF | C20 H20 Eu N O10 | C 1 2/c 1 | 16.395; 14.508; 9.627 90; 93.026; 90 | 2286.7 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546895 | CIF | C20 H20 N O10 Tb | C 1 2/c 1 | 16.302; 14.411; 9.5734 90; 93.006; 90 | 2246 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546896 | CIF | C20 H20 Dy N O10 | C 1 2/c 1 | 16.287; 14.437; 9.5971 90; 93.681; 90 | 2252 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546897 | CIF | C20 H20 N Nd O10 | C 1 2/c 1 | 16.3602; 14.51; 9.575 90; 92.566; 90 | 2270.7 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546898 | CIF | C20 H20 Er N O10 | C 1 2/c 1 | 16.312; 14.376; 9.5785 90; 93.332; 90 | 2242.4 | Zhu, Wen-Hua; Xiong, Xia; Gao, Chen; Li, Shan; Zhang, Yan; Wang, Juan; Zhang, Chi; Powell, Annie K.; Gao, Song A family of one-dimensional lanthanide complexes bridged by two distinct carboxylate ligands with the Dy analogue displaying magnetic relaxation behaviour Dalton Transactions, 2017, 46, 14114-14121 |
| 1546899 | CIF | C29 H36 B P | P b c a | 16.9924; 16.5973; 17.5163 90; 90; 90 | 4940.1 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546900 | CIF | C33 H44 B F3 N O3 P S | C 1 c 1 | 13.6317; 11.9518; 19.7278 90; 101.21; 90 | 3152.8 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546901 | CIF | C23 H33 B N P | P 1 21/c 1 | 8.4981; 18.446; 13.8292 90; 96.972; 90 | 2151.8 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546902 | CIF | C36 H42 B Cl2 F3 N O3 P S | P 21 21 21 | 11.0882; 17.6065; 18.5479 90; 90; 90 | 3621 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546903 | CIF | C28 H35 B N P | P 1 21/c 1 | 8.1447; 16.6623; 17.5476 90; 91.644; 90 | 2380.39 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546904 | CIF | C27 H36 B P | P b c a | 17.3762; 15.4227; 17.5727 90; 90; 90 | 4709.3 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546905 | CIF | C27 H40 B P | P -1 | 10.0726; 11.0362; 12.2129 88.259; 69.614; 78.174 | 1244.34 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546906 | CIF | C26 H39 B N P | C 1 c 1 | 11.4364; 14.5007; 14.8879 90; 93.698; 90 | 2463.81 | Habraken, Evi R. M.; Mens, Lars C.; Nieger, Martin; Lutz, Martin; Ehlers, Andreas W.; Slootweg, J. Chris Reactivity of the geminal phosphinoborane tBu <sub>2</sub> PCH <sub>2</sub> BPh <sub>2</sub> towards alkynes, nitriles, and nitrilium triflates Dalton Transactions, 2017, 46, 12284-12292 |
| 1546907 | CIF | C42 H67 Al Cl N2 | P 1 21/n 1 | 14.41; 17.145; 17.2175 90; 114.14; 90 | 3881.8 | Kundu, Subrata; Sinhababu, Soumen; Dutta, Sayan; Mondal, Totan; Koley, Debasis; Dittrich, Birger; Schwederski, Brigitte; Kaim, Wolfgang; Stückl, A. Claudia; Roesky, Herbert W. Synthesis and characterization of Lewis base stabilized mono- and di-organo aluminum radicals Chemical Communications, 2017, 53, 10516-10519 |
| 1546908 | CIF | C15 H16 Cl N O | P 21 21 21 | 8.6226; 13.6329; 22.798 90; 90; 90 | 2679.9 | Wang, Guo-Peng; Chen, Meng-Qing; Zhu, Shou-Fei; Zhou, Qi-Lin Enantioselective Nazarov cyclization of indole enones cooperatively catalyzed by Lewis acids and chiral Brønsted acids Chem. Sci., 2017 |
| 1546909 | CIF | C73 H48 Cl3 F12 O3 P3 Pd3 S4 | P 1 21/c 1 | 10.4508; 24.6808; 29.1391 90; 94.151; 90 | 7496.3 | Maestri, Giovanni; WANG, Yanlan; Monfredini, Anna; Deyris, Pierre-Alexandre; Derat, Etienne; Malacria, Max; Blanchard, Florent All-Metal Aromatic Cationic Palladium Triangles Can Mimic Aromatic Donor Ligands towards Lewis Acidic Cations Chem. Sci., 2017 |
| 1546910 | CIF | C88 H82 Ag Cl3 F21 O5 P3 Pd3 S3 Sb2 | P b c a | 21.8782; 22.7145; 39.349 90; 90; 90 | 19554.6 | Maestri, Giovanni; WANG, Yanlan; Monfredini, Anna; Deyris, Pierre-Alexandre; Derat, Etienne; Malacria, Max; Blanchard, Florent All-Metal Aromatic Cationic Palladium Triangles Can Mimic Aromatic Donor Ligands towards Lewis Acidic Cations Chem. Sci., 2017 |
| 1546911 | CIF | C72.75 H52.75 Ag B2 Cl5.25 F17 O2 P3 Pd3 S3 | P c c n | 19.9665; 30.9093; 32.546 90; 90; 90 | 20085.8 | Maestri, Giovanni; WANG, Yanlan; Monfredini, Anna; Deyris, Pierre-Alexandre; Derat, Etienne; Malacria, Max; Blanchard, Florent All-Metal Aromatic Cationic Palladium Triangles Can Mimic Aromatic Donor Ligands towards Lewis Acidic Cations Chem. Sci., 2017 |
| 1546912 | CIF | C0.75 K0.08 O3.52 Si1.5 | P -6 m 2 | 13.265; 13.265; 7.545 90; 90; 120 | 1149.8 | Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite Catal. Sci. Technol., 2017 |
| 1546913 | CIF | C14 K O40 Si18 | P -6 m 2 | 13.2558; 13.2558; 7.5358 90; 90; 120 | 1146.76 | Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite Catal. Sci. Technol., 2017 |
| 1546914 | CIF | C14 K O40 Si18 | P -6 m 2 | 13.2269; 13.2269; 7.5381 90; 90; 120 | 1142.1 | Łukaszuk, Katarzyna Anna; Rojo-Gama, Daniel; Øien-Ødegaard, Sigurd; Lazzarini, Andrea; Berlier, Gloria; Bordiga, Silvia; Lillerud, Karl Petter; Olsbye, Unni; Beato, Pablo; Lundegaard, Lars Fahl; Svelle, Stian Zeolite morphology and catalyst performance: Conversion of methanol to hydrocarbons over offretite Catal. Sci. Technol., 2017 |
| 1546915 | CIF | C21 H29 N O5 | P 1 21/c 1 | 19.8561; 7.9076; 12.5788 90; 101.555; 90 | 1935.02 | Ho (Kenny) Park, Kun; Chen, Rui; Chen, David Y.-K. Programmed serial stereochemical relay and its application in the synthesis of morphinans Chem. Sci., 2017 |
| 1546916 | CIF | C21 H28 O7 | P 21 21 21 | 8.087; 10.797; 22.609 90; 90; 90 | 1974.1 | Wang, Hengtao; Zhang, Xiunan; tang, pingping Total Synthesis of Schilancidilactones A, B and Schilancitrilactone A, 20-epi-Schilancitrilactone A via Late-stage Nickel-catalyzed cross coupling Chem. Sci., 2017 |
| 1546917 | CIF | C8 H12 I2 O2 | P 21 21 21 | 7.2879; 11.3154; 13.6084 90; 90; 90 | 1122.22 | Wang, Hengtao; Zhang, Xiunan; tang, pingping Total Synthesis of Schilancidilactones A, B and Schilancitrilactone A, 20-epi-Schilancitrilactone A via Late-stage Nickel-catalyzed cross coupling Chem. Sci., 2017 |
| 1546918 | CIF | C27 H22 N2 O2 | P -1 | 5.7431; 12.655; 15.118 69.385; 82.282; 87.431 | 1019.1 | Marichev, Kostiantyn O.; Garcia, Estevan C.; BHOWMICK, KARTICK CHANDRA; Wherritt, Daniel J.; Arman, Hadi; Doyle, Michael P. Highly selective acylation of polyamines and aminoglycosides by 5-acyl-5-phenyl-1,5-dihydro-4H-pyrazol-4-ones Chem. Sci., 2017 |
| 1546919 | CIF | C18 H15 N O2 | P -1 | 6.1284; 10.938; 11.925 114.2; 90.94; 91.43 | 728.6 | Li, Kai; Liu, Yuanyuan; Li, Yuanyuan; Feng, Qi; Hou, Hongwei; Tang, Ben Zhong 2,5-bis(4-alkoxycarbonylphenyl)-1,4-diaryl-1,4-dihydropyrrolo[3,2-b]pyrrole (AAPP) AIEgens: tunable RIR and TICT characteristics and their multifunctional applications Chem. Sci., 2017 |
| 1546920 | CIF | C19 H14 F3 N O2 | P -1 | 6.1875; 12.1177; 12.249 63.176; 88.118; 81.174 | 809.19 | Li, Kai; Liu, Yuanyuan; Li, Yuanyuan; Feng, Qi; Hou, Hongwei; Tang, Ben Zhong 2,5-bis(4-alkoxycarbonylphenyl)-1,4-diaryl-1,4-dihydropyrrolo[3,2-b]pyrrole (AAPP) AIEgens: tunable RIR and TICT characteristics and their multifunctional applications Chem. Sci., 2017 |
| 1546921 | CIF HKL Paper | C18 H21 Cl2 N O6 | P -1 | 4.7434; 6.8568; 15.0374 100.88; 92.184; 103.053 | 466.21 | Smith, Graham Ammonium hydrogen bis[(3-chloro-2-methylphenoxy)acetate] IUCrData, 2017, 2, x171223 |
| 1546922 | CIF HKL Paper | C8 H13 Cl N O0.5 | C 1 2/c 1 | 30.5325; 4.8966; 11.8973 90; 99.067; 90 | 1756.49 | Aarthi, R.; Thiruvalluvar, A.; Ramachandra Raja, C. 4-Methylbenzylammonium chloride hemihydrate IUCrData, 2017, 2, x171213 |
| 1546923 | CIF HKL Paper | C5 H6 N2 S | C 1 2/c 1 | 10.7775; 9.6848; 12.1792 90; 108.139; 90 | 1208.06 | Lampl, Martin; Laus, Gerhard; Wurst, Klaus; Huppertz, Hubert; Schottenberger, Herwig 1-Vinyl-4-imidazoline-2-thione IUCrData, 2017, 2, x171207 |
| 1546924 | CIF HKL | C13 H9 N3 | P 1 21 1 | 6.1708; 16.9596; 14.2882 90; 99.9699; 90 | 1472.74 | Abe, Ryosuke; Takase, Tsugiko; Oyama, Dai 2-(Pyridin-2-yl)-1,8-naphthyridine IUCrData, 2017, 2, x171221 |
| 1546925 | CIF | C16 H17 F3 N2 O3 S | P 43 21 2 | 7.13; 7.13; 66.238 90; 90; 90 | 3367.33 | Huang, Xiaoqiang; Luo, Shipeng; Burghaus, Olaf; Webster, Richard D.; Harms, Klaus; Meggers, Eric Combining the catalytic enantioselective reaction of visible-light-generated radicals with a by-product utilization system Chem. Sci., 2017 |
| 1546926 | CIF | C17 H19 N3 O2 S | P 1 21 1 | 15.7976; 12.996; 17.9469 90; 112.625; 90 | 3401 | Huang, Xiaoqiang; Luo, Shipeng; Burghaus, Olaf; Webster, Richard D.; Harms, Klaus; Meggers, Eric Combining the catalytic enantioselective reaction of visible-light-generated radicals with a by-product utilization system Chem. Sci., 2017 |
| 1546927 | CIF | C44 H46 Cl2 F6 N4 O3 P Rh | P -1 | 11.9931; 13.7713; 14.7325 89.48; 67.088; 79.592 | 2199.33 | Huang, Xiaoqiang; Luo, Shipeng; Burghaus, Olaf; Webster, Richard D.; Harms, Klaus; Meggers, Eric Combining the catalytic enantioselective reaction of visible-light-generated radicals with a by-product utilization system Chem. Sci., 2017 |
| 1546928 | CIF | C2 D5 N O2 | I 1 | 5.1; 6.285; 5.4295 85.815; 114.456; 104.136 | 153.545 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
| 1546929 | CIF | C2 D5 N O2 | P 1 n 1 | 5.023; 5.9846; 5.4946 90; 114.654; 90 | 150.11 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
| 1546930 | CIF | C2 D5 N O2 | P 1 21 1 | 5.0907; 6.25954; 5.3871 90; 113.261; 90 | 157.709 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
| 1546931 | CIF | C2 D5 N O2 | I 1 | 5.1029; 6.345; 5.4331 85.91; 114.26; 103.55 | 155.85 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
| 1546932 | CIF | C18 H33 N O3 Si | P -1 | 9.4673; 9.5452; 11.9144 112.855; 99.013; 93.323 | 971.51 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C–H bond insertion cascades Chem. Sci., 2017 |
| 1546933 | CIF | C15 H29 N O3 Si | P 21 21 21 | 9.0924; 16.5218; 23.0977 90; 90; 90 | 3469.8 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C–H bond insertion cascades Chem. Sci., 2017 |
| 1546934 | CIF | C16 H29 N O Si | P 1 21/n 1 | 7.5883; 30.7424; 7.7047 90; 107.783; 90 | 1711.49 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C–H bond insertion cascades Chem. Sci., 2017 |
| 1546935 | CIF | C17 H29 N O3 Si | P 21 21 21 | 8.9713; 12.6161; 31.4987 90; 90; 90 | 3565.11 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C–H bond insertion cascades Chem. Sci., 2017 |
| 1546936 | CIF | C24 H29 N O3 Si | P -1 | 8.717; 9.709; 14.13 108.586; 101.655; 97.748 | 1084.3 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C–H bond insertion cascades Chem. Sci., 2017 |
| 1546937 | CIF | C24 H27 N3 O2 Si | P 1 21/n 1 | 13.0101; 10.7484; 16.4288 90; 106.67; 90 | 2200.81 | Shih, Jiun-Le; Jansone-Popova, Santa; Huynh, Christopher; May, Jeremy A. Synthesis of azasilacyclopentenes and silanols via Huisgen cycloaddition-initiated C‒H bond insertion cascades Chem. Sci., 2017 |
| 1546938 | CIF | C5 H4 K N S2 | P 1 21/c 1 | 13.41; 14.04; 8.042 90; 100.64; 90 | 1488 | DeMartino, Anthony W.; Souza, Maykon Lima; Ford, Peter C. Uncaging Carbon Disulfide. Delivery Platforms for Potential Pharmacological Applications: A Mechanistic Approach. Chem. Sci., 2017 |
| 1546939 | CIF | C4 H3 K N2 S2 | P -1 | 7.425; 8.392; 11.614 78.314; 80.939; 89.287 | 699.7 | DeMartino, Anthony W.; Souza, Maykon Lima; Ford, Peter C. Uncaging Carbon Disulfide. Delivery Platforms for Potential Pharmacological Applications: A Mechanistic Approach. Chem. Sci., 2017 |
| 1546940 | CIF | C7 H18 K N O2 S2 | P 1 21/m 1 | 5.764; 28.756; 7.9313 90; 110.631; 90 | 1230.3 | DeMartino, Anthony W.; Souza, Maykon Lima; Ford, Peter C. Uncaging Carbon Disulfide. Delivery Platforms for Potential Pharmacological Applications: A Mechanistic Approach. Chem. Sci., 2017 |
| 1546941 | CIF | C27 H26 B F4 N O Si | P 1 21/n 1 | 9.6894; 14.7175; 17.3626 90; 92.186; 90 | 2474.2 | Wong, Man Kin; Deng, Jie-Ren; Chan, Wing-Cheung; Lai, Nathanael Chun-Him; Yang, Bin; Tsang, Chui-Shan; Ko, Ben, Chi-Bun; Chan, Sharon Lai-Fung Photosensitizer-free visible light-mediated gold-catalysed cis-difunctionalization of silyl-substituted alkynes Chem. Sci., 2017 |
| 1546942 | CIF | C106.943 H73.411 F7.411 N12 O14.4717 Ru3 | R 3 c :H | 26.1798; 26.1798; 30.736 90; 90; 120 | 18244 | Kunz, Valentin; Lindner, Joachim O.; Schulze, Marcus; Röhr, Merle I. S.; Schmidt, David; Mitrić, Roland; Würthner, Frank Cooperative water oxidation catalysis in a series of trinuclear metallosupramolecular ruthenium macrocycles Energy Environ. Sci., 2017 |
| 1546943 | CIF | Al2 O5 Ti | B b m m | 9.4359; 9.6425; 3.593 90; 90; 90 | 326.91 | Ohta, Y.; Kawauchi, Y.; Ban, T. Cation distribution of pseudobrookite-type titanates and their phase stability Journal of the Ceramic Society of Japan, 2017, 125, 695-700 |
| 1546944 | CIF | Ba Ni O5 Y2 | I m m m | 3.761; 5.761; 11.323 90; 90; 90 | 245.34 | J. Amador; E. Gutierrez-Puebla; M. A. Monge; I. Rasines; C. Ruiz-Valero; F. Fernandez; R. Saez-Puche; J. A. Campa Evidence of low-dimensional antiferromagnetic ordering and crystal structure in the R2BaNiO5 (R= Y, Er) oxides Physical Review B, 1990, 42, 7918-7924 |
| 1546945 | CIF | Ba Er2 Ni O5 | I m m m | 3.747; 5.737; 11.283 90; 90; 90 | 242.55 | J. Amador; E. Gutierrez-Puebla; M. A. Monge; I. Rasines; C. Ruiz-Valero; F. Fernandez; R. Saez-Puche; J. A. Campa Evidence of low-dimensional antiferromagnetic ordering and crystal structure in the R2BaNiO5 (R= Y, Er) oxides Physical Review B, 1990, 42, 7918-7924 |
| 1546946 | CIF | C45 H68 N10 O5 S | P 21 21 2 | 13.8373; 35.4652; 9.5082 90; 90; 90 | 4666.1 | Pulka-Ziach, Karolina; Sęk, Sławomir α-Helicomimetic foldamers as electron transfer mediators Nanoscale, 2017 |
| 1546947 | CIF | C44 H38 Si | P 1 2/c 1 | 8.6135; 10.2226; 19.2641 90; 93.739; 90 | 1692.6 | Lee, Jiwon; Park, Yoona; Jung, Joori; Han, Won-Sik Blue-Shifted Aggregation-Induced Emission of Siloles by Simple Structural Modification and Their Application as Nitro Explosive Chemosensor Photochem. Photobiol. Sci., 2017 |
| 1546948 | CIF | Cs Cu2 F5 | P 1 21/n 1 | 7.135; 7.386; 9.502 90; 97.19; 90 | 496.81 | Kaiser, V.; Babel, D. Structure of Cesium-containing Fluorides. IX. CsCu2F5, a Compound exhibiting Coordination Numbers 4, 5, and 6 for Copper(II) Zeitschrift fur anorganische und allgemeine Chemie, 1991, 595, 139-149 |
| 1546949 | CIF | C52 H19 Cl6 F20 N4 O S4 Sb | P -1 | 13.599; 14.523; 15.318 90.915; 105.079; 92.619 | 2916.8 | Panchal, Santosh P.; Anand, Venkataramanarao G. Oxidative Transformation of a Tetrathia S-Confused Isophlorin into Porphyrin Cation. Organic letters, 2017, 19, 4854-4857 |
| 1546950 | CIF | C30 H18 O2 S | P 1 21/c 1 | 17.946; 9.832; 13.938 90; 111.169; 90 | 2293 | Wang, Ming; Chen, Shihao; Jiang, Xuefeng Construction of Functionalized Annulated Sulfone via SO2/I Exchange of Cyclic Diaryliodonium Salts. Organic letters, 2017, 19, 4916-4919 |
| 1546951 | CIF | C30 H18 O2 S2 | P 1 21/c 1 | 17.278; 10.111; 13.842 90; 109.626; 90 | 2277.7 | Wang, Ming; Chen, Shihao; Jiang, Xuefeng Construction of Functionalized Annulated Sulfone via SO2/I Exchange of Cyclic Diaryliodonium Salts. Organic letters, 2017, 19, 4916-4919 |
| 1546952 | CIF | C13 H7 F3 O2 S | P n m a | 21.918; 6.9184; 8.0372 90; 90; 90 | 1218.7 | Wang, Ming; Chen, Shihao; Jiang, Xuefeng Construction of Functionalized Annulated Sulfone via SO2/I Exchange of Cyclic Diaryliodonium Salts. Organic letters, 2017, 19, 4916-4919 |
| 1546953 | CIF | C24 H25 Cl4 N2 Rh | P 1 21/c 1 | 16.3124; 13.3301; 11.8532 90; 109.949; 90 | 2422.8 | Cerón-Carrasco, José Pedro; Ruiz, José; Vicente, Consuelo; de Haro, Concepción; Bautista, Delia; Zúñiga, José; Requena, Alberto DFT Simulation of Structural and Optical Properties of 9-Aminoacridine Half-Sandwich Ru(II), Rh(III), and Ir(III) Antitumoral Complexes and Their Interaction with DNA. Journal of chemical theory and computation, 2017, 13, 3898-3910 |
| 1546954 | CIF | C19 H34 O3 | P 1 21 1 | 10.4703; 8.0849; 33.511 90; 92.726; 90 | 2833.5 | Gobu, Fekadu-Roge; Chen, Jian-Jun; Zeng, Jun; Wei, Wen-Jun; Wang, Wei-Feng; Lin, Chang-Jun; Gao, Kun Isolation, Structure Elucidition, and Immunosuppressive Activity of Diterpenoids from Ligularia fischeri. Journal of natural products, 2017, 80, 2263-2268 |
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