Crystallography Open Database
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COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 7101267 | CIF | V | I m -3 m | 3.026; 3.026; 3.026 90; 90; 90 | 27.708 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7101270 | CIF | V | I m -3 m | 3.02658; 3.02658; 3.02658 90; 90; 90 | 27.724 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7110559 | CIF | Li N Ni | P -6 m 2 | 3.758; 3.758; 3.54 90; 90; 120 | 43.3 | Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Siddons, Daniel J.; Smith, Susan E.; Edwards, Peter P.; Hamor, Thomas A. Novel layered lithium nitridonickelates; effect of Li vacancy concentration on N co-ordination geometry and Ni oxidation state Chemical Communications, 1999, 1187 |
| 7102756 | CIF | Co0.53 Li1.99 N | P 6/m m m | 3.7343; 3.7343; 3.607 90; 90; 120 | 43.56 | Gordon, Alexandra G; Smith, Ronald I; Wilson, Claire; Stoeva, Zlatka; Gregory, Duncan H Crystal growth, defect structure and magnetism of new Li3N-derived lithium nitridocobaltates. Chemical communications (Cambridge, England), 2004, 2812-2813 |
| 7105364 | CIF | ? | P 63 m c | 3.19868; 3.19868; 5.19278 90; 90; 120 | 46.0121 | Yashima, Masatomo; Yamada, Hiroki; Maeda, Kazuhiko; Domen, Kazunari Experimental visualization of covalent bonds and structural disorder in a gallium zinc oxynitride photocatalyst (Ga(1-x)Zn(x))(N(1-x)O(x)): origin of visible light absorption. Chemical communications (Cambridge, England), 2010, 46, 2379-2381 |
| 7101269 | CIF | Cu | F m -3 m | 3.61447; 3.61447; 3.61447 90; 90; 90 | 47.221 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7101264 | CIF | Cu | F m -3 m | 3.61696; 3.61696; 3.61696 90; 90; 90 | 47.318 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7100128 | CIF | N Na Sn | P 63 m c | 3.3306; 3.3306; 10.8919 90; 90; 120 | 104.636 | Simon Clarke; Oltan Gal; Nicholas Watney; D. Webster; Simon J. Clarke The first ternary tin (II) nitride: NaSnN Chemical Communications, 2005 |
| 1008882 | CIF | Na O3 | I m 2 m | 3.507; 5.7703; 5.2701 90; 90; 90 | 106.6 | Klein, W; Armbruster, K; Jansen, M Synthesis and crystal structure determination of sodium ozonide Chemical Communications, 1998, 1998, 707-708 |
| 7103014 | CIF | O2 Si | P 32 2 1 | 4.9115; 4.9115; 5.4038 90; 90; 120 | 112.892 | Henry, Paul F; Weller, Mark T; Wilson, Chick C Hydrogenous materials using powder neutron diffraction: full structural determination of adsorbed water molecules in a zeolite. Chemical communications (Cambridge, England), 2008, 1557-1559 |
| 7115847 | CIF | C4 H2 Li2 O4 | P -1 | 3.3392; 4.9297; 7.4736 76.777; 86.619; 78.68 | 117.42 | Hamish H.-M. Yeung; Monica Kosa; John M. Griffin; Clare P. Grey; Dan T. Major; Anthony K. Cheetham Topotactic elimination of water across a C-C ligand bond in a dense 3-D metal-organic framework Chem.Commun., 2014, 50, 13292 |
| 7120700 | CIF | Bi Ni | C m c m | 3.3873; 9.4079; 3.7587 90; 90; 90 | 119.78 | Powderly, Kelly M.; Clarke, Samantha M.; Amsler, Maximilian; Wolverton, Chris M.; Malliakas, Christos D.; Meng, Yue; Jacobsen, Steven D.; Freedman, Danna High-pressure discovery of β-NiBi Chem. Commun., 2017 |
| 7116665 | CIF | Fe1.172 H Li0.828 O S | P 4/n m m :1 | 3.7038; 3.7038; 8.8852 90; 90; 90 | 121.888 | U. Pachmayr; D. Johrendt [(Li0.8Fe0.2)OH]FeS and the ferromagnetic superconductors [(Li0.8Fe0.2)OH]Fe(S1-xSex) (0 < x ? 1) Chem.Commun., 2015, 51, 4689 |
| 7117021 | CIF | Gd H3 O3 | P 63/m | 6.2993; 6.2993; 3.6057 90; 90; 120 | 123.91 | Yan Yang; Qian-Chong Zhang; Yin-Yin Pan; La-Sheng Long; Lan-Sun Zheng Magnetocaloric effect and thermal conductivity of Gd(OH)3 and Gd2O(OH)4(H2O)2 Chem.Commun., 2015, 51, 7317 |
| 7129253 | CIF | Cu Fe O S | P 4/n m m :2 | 3.8219; 3.8219; 8.645 90; 90; 90 | 126.28 | Du, Wei; zhang, ganghua; Chen, Ping; Tang, Pingying; Wang, Jing; Li, Dezeng; Hou, Jingshan; Fang, Yongzheng Visible-light photoelectric response in semiconducting quaternary oxysulfide FeOCuS with anti-PbO-type structure Chemical Communications, 2021 |
| 7110560 | CIF | Li5 N3 Ni3 | P -6 2 m | 6.475; 6.475; 3.555 90; 90; 120 | 129.08 | Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Siddons, Daniel J.; Smith, Susan E.; Edwards, Peter P.; Hamor, Thomas A. Novel layered lithium nitridonickelates; effect of Li vacancy concentration on N co-ordination geometry and Ni oxidation state Chemical Communications, 1999, 1187 |
| 7101266 | CIF | O Sr | F m -3 m | 5.1326; 5.1326; 5.1326 90; 90; 90 | 135.21 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7102430 | CIF | O Sr | F m -3 m | 5.1432; 5.1432; 5.1432 90; 90; 90 | 136.05 | Hayward, M A Selective deintercalation of apex over face-shared oxide ions in the topotactic reduction of Sr7Mn4O15 to Sr7Mn4O12. Chemical communications (Cambridge, England), 2004, 170-171 |
| 7103589 | CIF | D0.09 O2 Ti | I 41/a m d :2 | 3.78582; 3.78582; 9.50739 90; 90; 90 | 136.264 | Chan, Wing K; Borghols, Wouter J H; Mulder, Fokko M Direct observation of space charge induced hydrogen ion insertion in nanoscale anatase TiO2. Chemical communications (Cambridge, England), 2008, 6342-6344 |
| 7128793 | CIF | C2 H5 N O2 | P 1 21 1 | 5.0757; 6.1737; 5.3882 90; 113.422; 90 | 154.931 | Hoser, Anna A.; Sztylko, Marcin; Trzybiński, Damian; Madsen, Anders Ø Theoretically derived thermodynamic properties can be improved by the refinement of low-frequency modes against X-ray diffraction data. Chemical communications (Cambridge, England), 2021, 57, 9370-9373 |
| 7129000 | CIF | Ca2 N2 Ni | I 4/m m m | 3.57206; 3.57206; 12.19453 90; 90; 90 | 155.598 | Kloß, Simon D; Attfield, J. Paul Low-dimensional magnetism in calcium nitridonickelate(II) Ca<sub>2</sub>NiN<sub>2</sub>. Chemical communications (Cambridge, England), 2021, 57, 10427-10430 |
| 7115973 | CIF | C4 Cu D8 F2 N2 O2 | P -1 | 4.9115; 5.4216; 6.187 99.8; 105.24; 92.078 | 156.07 | A. Lanza; C. Fiolka; M. Fisch; N. Casati; M. Skoulatos; C. Ruegg; K. W. Kramer; Piero Macchi New magnetic frameworks of [(CuF2(H2O)2)x(pyz)] Chem.Commun., 2014, 50, 14504 |
| 7121699 | CIF | Ba2 H3 N O6 | P -6 2 m | 6.9069; 6.9069; 3.8028 90; 90; 120 | 157.109 | Dong, Xuehua; Huang, Ling; Liu, Qingyu; Zeng, Hongmei; Lin, Zhien; Xu, Dingguo; Zou, Guohong Perfect balance harmony in Ba<sub>2</sub>NO<sub>3</sub>(OH)<sub>3</sub>: a beryllium-free nitrate as a UV nonlinear optical material. Chemical communications (Cambridge, England), 2018, 54, 5792-5795 |
| 7132179 | CIF | C2 H5 N O2 | P 1 21 1 | 5.0947; 6.2681; 5.3883 90; 113.232; 90 | 158.12 | Mettler, Marie; Dewandre, Adrien; Tumanov, Nikolay; Wouters, Johan; Septavaux, Jean Single crystal formation in core-shell capsules. Chemical communications (Cambridge, England), 2023 |
| 7130882 | CIF | Al Ca Dy O4 | I 4/m m m | 3.6501; 3.6501; 11.909 90; 90; 90 | 158.666 | Kazin, Pavel E.; Zykin, Mikhail; Dyakonov, Andrey K.; Vasiliev, Alexander V.; Karpov, Maxim A.; Gorbachev, Evgeny A.; Sleptsova, Anastasia E.; Jansen, Martin Dy3+ single ion magnet in the extended inorganic solid Ca(Y,Dy)AlO4 Chemical Communications, 2022 |
| 7103195 | CIF | Ag Br H3 N | P 1 21/m 1 | 4.1931; 5.873; 6.757 90; 97.553; 90 | 164.955 | Chippindale, Ann M; Head, Laura E; Hibble, Simon J Simple linear asymmetrical complexes of silver(I): NC-Ag-NH3 and Br-Ag-NH3. Chemical communications (Cambridge, England), 2008, 3010-3012 |
| 7105575 | CIF | Al4.8 O9.6 Si1.2 | P b a m | 7.588; 7.688; 2.8895 90; 90; 90 | 168.56 | Zhang, Pengyu; Liu, Jiachen; Du, Haiyan; Li, Sha; Xu, Rui A facile preparation of mullite [Al(2)(Al(2.8)Si(1.2))O(9.6)] nanowires by B(2)O(3)-doped molten salts synthesis. Chemical communications (Cambridge, England), 2010, 46, 3988-3990 |
| 7126022 | CIF | C2 H5 Na O | P -4 21 m | 4.41084; 4.41084; 9.06779 90; 90; 90 | 176.418 | Beske, Maurice; Tapmeyer, Lukas; Schmidt, Martin U. Crystal structure of sodium ethoxide (C<sub>2</sub>H<sub>5</sub>ONa), unravelled after 180 years. Chemical communications (Cambridge, England), 2020, 56, 3520-3523 |
| 7130954 | CIF | D3.8 La4 Li2 N1.69 O2.31 | I 4/m m m | 3.65603; 3.65603; 13.3557 90; 90; 90 | 178.52 | Zapp, Nicolas; Oehler, Florian; Bertmer, Marko; Auer, Henry; Sheptyakov, Denis; Ritter, Clemens; Kohlmann, Holger Aliovalent anion substitution as a design concept for heteroanionic Ruddlesden–Popper hydrides Chemical Communications, 2022 |
| 7130953 | CIF | H3.13 La4 Li2 N1.68 O2.32 | I 4/m m m | 3.6574; 3.6574; 13.3679 90; 90; 90 | 178.817 | Zapp, Nicolas; Oehler, Florian; Bertmer, Marko; Auer, Henry; Sheptyakov, Denis; Ritter, Clemens; Kohlmann, Holger Aliovalent anion substitution as a design concept for heteroanionic Ruddlesden–Popper hydrides Chemical Communications, 2022 |
| 7132177 | CIF | Cl Na | F m -3 m | 5.6357; 5.6357; 5.6357 90; 90; 90 | 178.996 | Mettler, Marie; Dewandre, Adrien; Tumanov, Nikolay; Wouters, Johan; Septavaux, Jean Single crystal formation in core-shell capsules. Chemical communications (Cambridge, England), 2023 |
| 7101738 | CIF | Ge | F d -3 m :2 | 5.6455; 5.6455; 5.6455 90; 90; 90 | 179.93 | Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system. Chemical communications (Cambridge, England), 2007, 837-839 |
| 7101739 | CIF | Ge | F d -3 m :2 | 5.6575; 5.6575; 5.6575 90; 90; 90 | 181.08 | Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system. Chemical communications (Cambridge, England), 2007, 837-839 |
| 7111201 | CIF | C6 H12 N2 O2 | P -1 | 5.1097; 5.5722; 7.0473 69.575; 87.12; 75.465 | 181.865 | Seaton, Colin C.; Tremayne, Maryjane Differential evolution: crystal structure determination of a triclinic polymorph of adipamide from powder diffraction data Chemical Communications, 2002, 880 |
| 7130952 | CIF | D4.92 La4 Li2 N3.08 | I 4/m m m | 3.69312; 3.69312; 13.41285 90; 90; 90 | 182.94 | Zapp, Nicolas; Oehler, Florian; Bertmer, Marko; Auer, Henry; Sheptyakov, Denis; Ritter, Clemens; Kohlmann, Holger Aliovalent anion substitution as a design concept for heteroanionic Ruddlesden–Popper hydrides Chemical Communications, 2022 |
| 7130951 | CIF | D4.84 La4 Li2 N3.16 | I 4/m m m | 3.69326; 3.69326; 13.4133 90; 90; 90 | 182.96 | Zapp, Nicolas; Oehler, Florian; Bertmer, Marko; Auer, Henry; Sheptyakov, Denis; Ritter, Clemens; Kohlmann, Holger Aliovalent anion substitution as a design concept for heteroanionic Ruddlesden–Popper hydrides Chemical Communications, 2022 |
| 7132674 | CIF | B2 F O4 Sb | P -1 | 4.3436; 6.3169; 7.0009 92.888; 95.126; 104.803 | 184.44 | Hu, Chenhui; Wu, Mengfan; Han, Jian; Yang, Zhihua; Han, Shujuan; Pan, Shilie New antimony fluorooxoborates with strong birefringence and unprecedented structural characterisation. Chemical communications (Cambridge, England), 2024, 60, 2653-2656 |
| 7130003 | CIF | C2 Cl3 N Pb | P m -3 m | 5.761; 5.761; 5.761 90; 90; 90 | 191.203 | Petrosova, Hanna R.; Kucheriv, Olesia I.; Shova, Sergiu; Gural'skiy, Il'ya A. Aziridinium cation templating 3D lead halide hybrid perovskites Chemical Communications, 2022 |
| 7101268 | CIF | Li3.62 Mn O2 S3 Sr2 | P 4/m m m | 4.05416; 4.05416; 11.79624 90; 90; 90 | 193.885 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7101077 | CIF | C6 H10 Cl2 N2 | P -1 | 4.285; 5.8053; 8.6259 71.035; 76.868; 79.631 | 196.3 | Jonathan Steed; Kirsty Anderson; Andres E. Goeta; Kirsty S. B. Hancock Unusual variations in the incidence of Z'>1 in oxo-anion structures Chemical Communications, 2006 |
| 7114937 | CIF | C4 H16 B2 N2 | P -1 | 5.833; 6.029; 6.24 80.372; 81.533; 65.942 | 196.8 | Jaska, Cory A.; Temple, Karen; Lough, Alan J.; Manners, Ian Rhodium-catalyzed formation of boron‒nitrogen bonds: a mild route to cyclic aminoboranes and borazines Chemical Communications, 2001, 962 |
| 7104410 | CIF | C H3 O3 | P 1 21/n 1 | 5.744; 3.098; 11.63 90; 106.15; 90 | 198.8 | Casati, Nicola; Macchi, Piero; Sironi, Angelo Hydrogen migration in oxalic acid di-hydrate at high pressure? Chemical communications (Cambridge, England), 2009, 34, 2679-2681 |
| 7104686 | CIF | As2 Ba0.9 Fe2 Sn0.1 | I 4/m m m | 3.9297; 3.9297; 13.158 90; 90; 90 | 203.2 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7104682 | CIF | As2 Ba0.5 Fe2 K0.4 Sn0.1 | I 4/m m m | 3.9021; 3.9021; 13.3538 90; 90; 90 | 203.33 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7104683 | CIF | As2 Ba0.61 Fe2 K0.35 Sn0.04 | I 4/m m m | 3.9063; 3.9063; 13.352 90; 90; 90 | 203.75 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7104681 | CIF | As2 Ba0.34 Fe2 K0.66 | I 4/m m m | 3.8822; 3.8822; 13.5396 90; 90; 90 | 204.06 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7104685 | CIF | As2 Ba0.78 Fe2 K0.12 Sn0.1 | I 4/m m m | 3.922; 3.922; 13.285 90; 90; 90 | 204.38 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7101499 | CIF | B2 Os1.42 Ru Ti1.58 | P -6 2 m | 8.8554; 8.8554; 3.0336 90; 90; 120 | 206.02 | B.P.Fokwa T.; J.von Appen; R.Dronskowski Synthesis of a missing structural link: The first trigonal planar B4 units in the novel complex boride Ti1+xOs2_xRuB2 (x = 0.6) Chemical Communications, 2006 |
| 7104409 | CIF | C H3 O3 | P 1 21/n 1 | 5.8093; 3.1657; 11.676 90; 106.01; 90 | 206.39 | Casati, Nicola; Macchi, Piero; Sironi, Angelo Hydrogen migration in oxalic acid di-hydrate at high pressure? Chemical communications (Cambridge, England), 2009, 34, 2679-2681 |
| 7104684 | CIF | As2 Ba0.68 Fe2 K0.24 Sn0.07 | I 4/m m m | 3.946; 3.946; 13.431 90; 90; 90 | 209.1 | Mathieu, Josiah L; Latturner, Susan E Zintl phase as dopant source in the flux synthesis of Ba(1-x)K(x)Fe(2)As(2) type superconductors. Chemical communications (Cambridge, England), 2009, 34, 4965-4967 |
| 7123351 | CIF | Bi | R -3 m | 4.5392; 4.5392; 11.8347 90; 90; 120 | 211.18 | Wei, Zheng; Dubceac, Cristina; Petrukhina, Marina A.; Dikarev, Evgeny V. From a volatile molecular precursor to twin-free single crystals of bismuth Chemical Communications, 2019 |
| 7123352 | CIF | Bi | R -3 m | 4.5481; 4.5481; 11.86 90; 90; 120 | 212.46 | Wei, Zheng; Dubceac, Cristina; Petrukhina, Marina A.; Dikarev, Evgeny V. From a volatile molecular precursor to twin-free single crystals of bismuth Chemical Communications, 2019 |
| 7130002 | CIF | C2 Br3 N Pb | P m -3 m | 5.9739; 5.9739; 5.9739 90; 90; 90 | 213.193 | Petrosova, Hanna R.; Kucheriv, Olesia I.; Shova, Sergiu; Gural'skiy, Il'ya A. Aziridinium cation templating 3D lead halide hybrid perovskites Chemical Communications, 2022 |
| 7101076 | CIF | C6 H10 Br2 N2 | P -1 | 4.4488; 6.089; 8.701 103.616; 104.616; 101.392 | 213.2 | Jonathan Steed; Kirsty Anderson; Andres E. Goeta; Kirsty S. B. Hancock Unusual variations in the incidence of Z'>1 in oxo-anion structures Chemical Communications, 2006 |
| 7119152 | CIF | C2 H6 Cd | P 42/m n m | 7.195; 7.195; 4.118 90; 90; 90 | 213.2 | Hanke, Felix; Hindley, Sarah; Jones, Anthony C.; Steiner, Alexander The solid state structures of the high and low temperature phases of dimethylcadmium Chemical Communications, 2016, 52, 10144 |
| 7123012 | CIF | Co Mn2 O6 Re | P 1 21/n 1 | 5.2356; 5.3536; 7.633 90; 89.9627; 90 | 213.948 | Frank , Corey E.; McCabe, Emma; Orlandi, Fabio; Manuel, Pascal; Tan, Xiaoyan; Deng, Zheng; Croft, Mark; Cascos, Vanessa Amelia; Emge, Thomas J.; Feng, Hai; Lapidus, Saul H.; Jin, Changqing; Wu, Meixia; Li, Man-Rong; Ehrlich, Steven N.; Khalid, Syed; Quackenbush, Nicholas F.; Yu, Shuang; Walker, David; Greenblatt, Martha Mn2CoReO6: A Robust Multisublattice Antiferromagnetic Perovskite with Small A-Site Cations Chemical Communications, 2019 |
| 7130785 | CIF | C Br3 N2 Pb | P m -3 m | 5.9968; 5.9968; 5.9968 90; 90; 90 | 215.65 | Li, Chengmin; Juarez-Perez, Emilio J.; Mayoral, Alvaro Atomic understanding of Formamidinium Hybrid Halide Perovskite, FAPbBr3 Chemical Communications, 2022 |
| 7117866 | CIF | Ba0.5 F2 O2 Pd Sr1.5 | I 4/m m m | 4.0701; 4.0701; 13.1072 90; 90; 90 | 217.13 | Baikie, T.; Dixon, E.L.; Rooms, J.F.; Francesconi, M.G.; Young, N.A. Ba2-x Srx Pd O2 F2 (0 <= x <= 1.5): the first palladium - oxide - fluorides Chemical Communications, 2003, 2003, 1580-1581 |
| 7101265 | CIF | S Sr | F m -3 m | 6.019; 6.019; 6.019 90; 90; 90 | 218.05 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7131812 | CIF | C8 H8 F2 O4 | P -1 | 5.657; 6.5148; 6.5836 102.961; 109.449; 96.622 | 218.14 | Sharma, Ruchi; Jain, Swati; Sihag, Naveen; Yadav, M. Ramu Ligand-free Pd-catalyzed double Heck reaction of <i>N</i>-(<i>o</i>-bromoaryl)acrylamides with α-F/CF<sub>3</sub>-acrylates. Chemical communications (Cambridge, England), 2023 |
| 7104408 | CIF | C H3 O3 | P 1 21/n 1 | 5.983; 3.331; 11.833 90; 106.15; 90 | 226.5 | Casati, Nicola; Macchi, Piero; Sironi, Angelo Hydrogen migration in oxalic acid di-hydrate at high pressure? Chemical communications (Cambridge, England), 2009, 34, 2679-2681 |
| 7130869 | CIF | B2 Be2 O6 Pb | P m n 21 | 10.737; 4.7501; 4.5368 90; 90; 90 | 231.39 | Chen, Yi-Gang; Jiang, Xingxing; Yang, Yuanyu; Dai, Zhe; Lin, Zheshuai; Zhang, Xian-Ming PbBe2B2O6: An Excellent Ultraviolet Nonlinear-Optical Crystal with Unprecedented π-π Interacting BeBO5 Group Chemical Communications, 2022 |
| 7100673 | CIF | C4 H4 O4 | P 1 c 1 | 3.6933; 7.484; 8.5933 90; 102.22; 90 | 232.14 | W. Jones; Graeme Day; W.D.Sam Motherwell; Andrew V. Trask Investigating the latent polymorphism of maleic acid Chemical Communications, 2006 |
| 7105956 | CIF | C H6 N4 O3 | P 1 c 1 | 4.867; 4.845; 10.14 90; 102.91; 90 | 233.06 | Andrzej Katrusiak; Marek Szafranski; Marcin Podsiadlo Pressure-induced collapse of guanidinium nitrate NâHâ ââO bonded honeycomb layers into a 3-D pattern with varied H-acceptor capacity Chem.Commun., 2011, 47, 2107 |
| 7112516 | CIF | C2 H5 N O2 | P 31 | 7.0111; 7.0111; 5.4843 90; 90; 120 | 233.47 | Ishikawa, Kazuhiko; Tanaka, Masahito; Suzuki, Toshiya; Sekine, Akiko; Kawasaki, Tsuneomi; Soai, Kenso; Shiro, Motoo; Lahav, Meir; Asahi, Toru Absolute chirality of the γ-polymorph of glycine: correlation of the absolute structure with the optical rotation. Chemical communications (Cambridge, England), 2012, 48, 6031 |
| 7112517 | CIF | C2 H5 N O2 | P 32 | 7.01706; 7.01706; 5.48499 90; 90; 120 | 233.893 | Ishikawa, Kazuhiko; Tanaka, Masahito; Suzuki, Toshiya; Sekine, Akiko; Kawasaki, Tsuneomi; Soai, Kenso; Shiro, Motoo; Lahav, Meir; Asahi, Toru Absolute chirality of the γ-polymorph of glycine: correlation of the absolute structure with the optical rotation. Chemical communications (Cambridge, England), 2012, 48, 6031 |
| 7117865 | CIF | Ba2 F2 O2 Pd | I 4/m m m | 4.1398; 4.1398; 14.0459 90; 90; 90 | 240.718 | Baikie, T.; Rooms, J.F.; Dixon, E.L.; Young, N.A.; Francesconi, M.G. Ba2-x Srx Pd O2 F2 (0 <= x <= 1.5): the first palladium - oxide - fluorides Chemical Communications, 2003, 2003, 1580-1581 |
| 7105955 | CIF | C H6 N4 O3 | P 1 c 1 | 4.895; 4.8916; 10.337 90; 101.56; 90 | 242.49 | Andrzej Katrusiak; Marek Szafranski; Marcin Podsiadlo Pressure-induced collapse of guanidinium nitrate NâHâ ââO bonded honeycomb layers into a 3-D pattern with varied H-acceptor capacity Chem.Commun., 2011, 47, 2107 |
| 7117254 | CIF | C12 H18 | P -1 | 5.246; 6.1956; 7.9824 103.859; 98.602; 100.131 | 242.93 | Viswanadha G. Saraswatula; Binoy K. Saha A thermal expansion investigation of the melting point anomaly in trihalomesitylenes Chem.Commun., 2015, 51, 9829 |
| 7105954 | CIF | C H6 N4 O3 | P 1 c 1 | 4.899; 4.917; 10.35 90; 100.8; 90 | 244.9 | Andrzej Katrusiak; Marek Szafranski; Marcin Podsiadlo Pressure-induced collapse of guanidinium nitrate NâHâ ââO bonded honeycomb layers into a 3-D pattern with varied H-acceptor capacity Chem.Commun., 2011, 47, 2107 |
| 7117255 | CIF | C12 H18 | P -1 | 5.2512; 6.2279; 7.9892 103.846; 98.464; 99.919 | 245 | Viswanadha G. Saraswatula; Binoy K. Saha A thermal expansion investigation of the melting point anomaly in trihalomesitylenes Chem.Commun., 2015, 51, 9829 |
| 7117256 | CIF | C12 H18 | P -1 | 5.2639; 6.2567; 8.0155 103.858; 98.504; 99.75 | 247.65 | Viswanadha G. Saraswatula; Binoy K. Saha A thermal expansion investigation of the melting point anomaly in trihalomesitylenes Chem.Commun., 2015, 51, 9829 |
| 7117257 | CIF | C12 H18 | P -1 | 5.2748; 6.2602; 8.0316 103.949; 98.651; 99.531 | 248.77 | Viswanadha G. Saraswatula; Binoy K. Saha A thermal expansion investigation of the melting point anomaly in trihalomesitylenes Chem.Commun., 2015, 51, 9829 |
| 7110706 | CIF | Al2 Cs2 O9 P2 | P -1 | 4.925; 7.121; 8.066 96.51; 107.12; 108.68 | 249.28 | Huang, Qun; Hwu, Shiou-Jyh Cs2Al2P2O9: an exception to Löwenstein’s rule. Synthesis and characterization of a novel layered aluminophosphate containing linear Al‒O‒Al linkages Chemical Communications, 1999, 2343 |
| 7131120 | CIF | C H6 I P | P 1 21/m 1 | 4.7369; 6.5201; 8.0744 90; 90.914; 90 | 249.35 | Zhang, Han-Yue; Xiong, Ren-Gen Three-dimensional narrow-bandgap perovskite semiconductor ferroelectric methylphosphonium tin triiodide for potential photovoltaic application. Chemical communications (Cambridge, England), 2023, 59, 920-923 |
| 7117258 | CIF | C12 H18 | P -1 | 5.2944; 6.2771; 8.0612 104.026; 98.839; 99.456 | 251.09 | Viswanadha G. Saraswatula; Binoy K. Saha A thermal expansion investigation of the melting point anomaly in trihalomesitylenes Chem.Commun., 2015, 51, 9829 |
| 7104407 | CIF | C H3 O3 | P 1 21/n 1 | 6.1169; 3.6053; 12.049 90; 106.303; 90 | 255.05 | Casati, Nicola; Macchi, Piero; Sironi, Angelo Hydrogen migration in oxalic acid di-hydrate at high pressure? Chemical communications (Cambridge, England), 2009, 34, 2679-2681 |
| 7131119 | CIF | C H6 I3 P Sn | P -4 3 m | 6.3464; 6.3464; 6.3464 90; 90; 90 | 255.613 | Zhang, Han-Yue; Xiong, Ren-Gen Three-dimensional narrow-bandgap perovskite semiconductor ferroelectric methylphosphonium tin triiodide for potential photovoltaic application. Chemical communications (Cambridge, England), 2023, 59, 920-923 |
| 7123322 | CIF | Ga Ge2 Re | C m c m | 3.26861; 9.17461; 8.53206 90; 90; 90 | 255.861 | Likhanov, Maxim; Khalaniya, Roman A.; Verchenko, Valeriy; Gippius, Andrei; Zhurenko, Sergei; Tkachev, Alexey V.; Fazlizhanova, Dina I.; Kuznetsov, Alexey N.; Shevelkov, Andrei V. ReGaGe2: Intermetallic Compound with Semiconducting Properties and Localized Bonding Chemical Communications, 2019 |
| 7130004 | CIF | C2 I3 N Pb | P m -3 m | 6.364; 6.364; 6.364 90; 90; 90 | 257.75 | Petrosova, Hanna R.; Kucheriv, Olesia I.; Shova, Sergiu; Gural'skiy, Il'ya A. Aziridinium cation templating 3D lead halide hybrid perovskites Chemical Communications, 2022 |
| 7126155 | CIF | Bi Cu O Se2 Sr | P 1 21/m 1 | 7.6529; 4.0559; 9.1405 90; 113.758; 90 | 259.67 | Luo, Mengjia; Bu, Kejun; Zhang, Xian; Huang, Jian; Wang, Ruiqi; Huang, Fuqiang Intrinsically low thermal conductivity in a p-type semiconductor SrOCuBiSe<sub>2</sub> with a [SrO]-intercalated CuBiSe<sub>2</sub> structure. Chemical communications (Cambridge, England), 2020, 56, 4356-4359 |
| 7119176 | CIF | Mn1.5 N O13 V4 | P 1 2/m 1 | 8.2011; 3.5207; 9.9129 90; 110.987; 90 | 267.234 | Martin K. Dufficy; Lan Luo; Peter S. Fedkiw; Paul A. Maggard Vacancy-induced manganese vanadates and their potential application to Li-ion batteries Chem.Commun., 2016, 52, 7509 |
| 7117434 | CIF | Li O8 Sb3 | P 1 21/a 1 | 10.2578; 4.7063; 5.6017 90; 96.467; 90 | 268.708 | Lopes, M.E.; Kirk, C.A.; Blake, S.M.; Marr, J.; West, A.R. Li Sb3 O8: the first tetrarutile structure Chemical Communications, 2000, 2000, 1951-1952 |
| 7101829 | CIF | C16 H8 N2 | P -1 | 3.7987; 8.398; 9.104 72.177; 78.528; 89.785 | 270.45 | Li, Jian-Rong; Tao, Ying; Yu, Qun; Bu, Xian-He A pcu-type metal-organic framework with spindle [Zn7(OH)8]6+ cluster as secondary building units. Chemical communications (Cambridge, England), 2007, 1527-1529 |
| 7101119 | CIF | Cu2 H4 Na2 O13 Si4 | P -1 | 5.2228; 6.4109; 8.5169 101.107; 94.34; 102.48 | 271.16 | Brandao, P.; Almeida Paz, Filipe A.; Rocha, Joao A Novel Microporous Copper Silicate: Na2Cu2Si4O11.2H2O Chemical Communications, 2005 |
| 7125453 | CIF | Cu3 Li O6 Ru2 | C 1 2/m 1 | 5.208536; 9.023652; 6.027403 90; 106.64; 90 | 271.424 | Huang, Bin; Liu, Ziyi; Han, Yifeng; Zhao, Shuang; Wu, Meixia; Frank, Corey E.; Greenblatt, Martha; Croft, Mark; Quackenbush, Nicholas F.; Liu, Sizhan; Tyson, Trevor A.; Zhang, Lei; Sun, Junliang; Shan, Pengfei; Dai, Jianhong; Yu, Xiaohui; Cheng, Jinguang; Li, Man-Rong Nonmetallic metal toward a pressure-induced bad-metal state in two-dimensional Cu<sub>3</sub>LiRu<sub>2</sub>O<sub>6</sub>. Chemical communications (Cambridge, England), 2019, 56, 265-268 |
| 7106717 | CIF | C2 H2 Cl4 | P 1 21/c 1 | 6.1941; 6.186; 7.361 90; 104.9; 90 | 272.57 | Maciej Bujak; Dieter Blaser; Andrzej Katrusiak; Roland Boese Conformational Polymorphs of 1,1,2,2-Tetrachloroethane: Pressure vs.Temperature Chem.Commun., 2011, 47, 8769 |
| 7111421 | CIF | Hf Mo Sb4 | C 1 2/m 1 | 10.321; 3.6475; 8.393 90; 119.895; 90 | 273.92 | Derakhshan, Shahab; Kleinke, Katja M.; Dashjav, Enkhtsetseg; Kleinke, Holger HfMoSb4, the first nonmetallic early transition metal antimonide Chemical Communications, 2004, 2428-2429 |
| 7111948 | CIF | C4 H12 Cd N10 | P m -3 m | 6.5228; 6.5228; 6.5228 90; 90; 90 | 277.525 | Zi-Yi Du; Ying-Ping Zhao; Wei-Xiong Zhang; Hao-Long Zhou; Chun-Ting He; Wei Xue; Bao-Ying Wang; Xiao-Ming Chen Above-room-temperature ferroelastic phase transition in a perovskite-like compound [N(CH3)4][Cd(N3)3] Chem.Commun., 2014, 50, 1989 |
| 7129652 | CIF | C12 Mn5 O12 | P 6/m m m | 7.4696; 7.4696; 5.847 90; 90; 120 | 282.5 | Wu, Xiaoyu; Wu, Haowei; Wu, Sicheng; Sun, Yimeng; Zhu, Jia; Zou, Ye; Xu, Wei; Zhu, Daoben Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions Chemical Communications, 2022 |
| 7117504 | CIF | Ba2 O6 Ta Y | I 4/m | 5.8851; 5.8851; 8.3474 90; 90; 90 | 289.107 | Lufaso, M.W.; Vogt, T.; Lee, Y.; Macquart, R.B.; zur Loye, H.C. Pressure induced octahedral tilting distortion in Ba2 Y Ta O6 Chemical Communications, 2006, 2006, 168-170 |
| 7106121 | CIF | N9 Sb | P -1 | 6.6694; 6.9045; 7.0314 83.651; 65.85; 83.595 | 292.85 | Stephan Schulz; Benjamin Lyhs; Georg Jansen; Dieter Blaser; Christoph Wolper Syntheses and Structures of Triazides of Heavy Group 15 Elements Chem.Commun., 2011, 47, 3401 |
| 7115205 | CIF | C4 H2 Mn2 O6 | P 1 21/c 1 | 3.376; 10.268; 8.575 90; 99.82; 90 | 292.9 | Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T. New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese† Chemical Communications, 1999, 1561 |
| 7115207 | CIF | C4 H2 Mn2 O6 | P 1 21/c 1 | 3.377; 10.269; 8.573 90; 99.8; 90 | 292.96 | Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T. New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese† Chemical Communications, 1999, 1561 |
| 7115206 | CIF | C4 H2 Mn2 O6 | P 1 21/c 1 | 3.377; 10.268; 8.576 90; 99.81; 90 | 293.02 | Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T. New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese† Chemical Communications, 1999, 1561 |
| 7115208 | CIF | C4 H2 Mn2 O6 | P 1 21/c 1 | 3.381; 10.268; 8.579 90; 99.85; 90 | 293.4 | Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T. New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese† Chemical Communications, 1999, 1561 |
| 7106942 | CIF | C H4 N2 O2 | P 21 21 21 | 4.6021; 7.3673; 8.6802 90; 90; 90 | 294.3 | Byeongno Lee; Seung Hee Kang; Donghyeon Kang; Kyu Hyung Lee; Jaeheung Cho; Wonwoo Nam; Oc Hee Han; Nam Hwi Hur Isolation and structural characterization of the elusive 1 : 1 adduct of hydrazine and carbon dioxide Chem.Commun., 2011, 47, 11219 |
| 7131057 | CIF | C15 H9 N O4 | P 1 | 3.855; 6.9039; 11.2145 91.025; 93.364; 96.825 | 295.75 | Duan, Wenzeng; Liu, Wenjing; Liu, Houting; Ji, Honghan; Huo, Yanmin; Wang, Huaiwei; Gong, Shuwen AIE-active aurones for circularly polarized luminescence and trace water detection. Chemical communications (Cambridge, England), 2022 |
| 7101263 | CIF | Li1.89 Mn O2 S2 Sr2 | I 4/m m m | 4.07036; 4.07036; 17.8721 90; 90; 90 | 296.101 | Simon Clarke; Oliver J. Rutt; Gareth R. Williams Reversible lithium insertion and copper extrusion in layered oxysulfides Chemical Communications, 2006 |
| 7117863 | CIF | Cu2 S4 W | I -4 2 m | 5.44427; 5.44427; 10.0687 90; 90; 90 | 298.437 | Crossland, C.J.; Evans, J.S.O. Synthesis and characterisation of a new high pressure polymorph of Cu2 W S4 Chemical Communications, 2003, 2003, 2292-2293 |
| 7119756 | CIF | Mg Mn2 O4 | I 41/a m d :2 | 5.753355; 5.753355; 9.132367 90; 90; 90 | 302.291 | Yin, Jiefu; Brady, Alexander B.; Takeuchi, Esther S.; Marschilok, Amy C.; Takeuchi, Kenneth J. Magnesium-ion battery-relevant electrochemistry of MgMn2O4: crystallite size effects and the notable role of electrolyte water content. Chemical communications (Cambridge, England), 2017, 53, 3665-3668 |
| 7124031 | CIF | B H4 I O7 Sr | P -1 | 6.595; 6.868; 7.12 96.73; 108.18; 92.37 | 303.2 | Peng, Guang; Lin, Chensheng; Zhao, Dan; Cao, Liling; Fan, Huixin; Chen, Kaichuang; Ye, Ning Sr[B(OH)4](IO3) and Li4Sr5[B12O22(OH)4](IO3)2: Two Unprecedented Metal Borate-Iodates Showing Subtle Balance of Enlarged Band Gap and Birefringence Chemical Communications, 2019 |
| 7128792 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.0867; 11.7982; 5.4598 90; 111.983; 90 | 303.84 | Hoser, Anna A.; Sztylko, Marcin; Trzybiński, Damian; Madsen, Anders Ø Theoretically derived thermodynamic properties can be improved by the refinement of low-frequency modes against X-ray diffraction data. Chemical communications (Cambridge, England), 2021, 57, 9370-9373 |
| 7119755 | CIF | Mg0.25 Mn0.5 O | I 41/a m d :2 | 5.721406; 5.721406; 9.298237 90; 90; 90 | 304.373 | Yin, Jiefu; Brady, Alexander B.; Takeuchi, Esther S.; Marschilok, Amy C.; Takeuchi, Kenneth J. Magnesium-ion battery-relevant electrochemistry of MgMn2O4: crystallite size effects and the notable role of electrolyte water content. Chemical communications (Cambridge, England), 2017, 53, 3665-3668 |
| 7130896 | CIF | C6 H9 F3 | P -1 | 4.7654; 6.2994; 10.5867 89.429; 89.677; 73.64 | 304.92 | O'Hagan, David; Yu, Cihang; Cormanich, Rodrigo A.; Slawin, Alexandra; Cordes, David Bradford; Piscelli, Bruno A.; Al-Maharik, Nawaf Unexpected triaxial preferences in some all-syn 1,3,5-trifluorocyclohexanes Chemical Communications, 2022 |
| 7111634 | CIF | C4 H5 N O4 S | P -1 | 6.331; 7.472; 7.715 62.546; 73.171; 77.874 | 308.73 | Velaga, Sitaram P.; Vangala, Venu R.; Basavoju, Srinivas; Boström, Dan Polymorphism in acesulfame sweetener: structure‒property and stability relationships of bending and brittle crystals Chemical Communications, 2010, 46, 3562-3564 |
| 7132178 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.1018; 11.9664; 5.4624 90; 111.73; 90 | 309.78 | Mettler, Marie; Dewandre, Adrien; Tumanov, Nikolay; Wouters, Johan; Septavaux, Jean Single crystal formation in core-shell capsules. Chemical communications (Cambridge, England), 2023 |
| 7115193 | CIF | C4 Co N6 | P n n m | 7.0433; 5.9748; 7.4039 90; 90; 90 | 311.57 | Jensen, Paul; Batten, Stuart R.; Fallon, Gary D.; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J. Structural isomers of M(dca)2 molecule-based magnets. Crystal structure of tetrahedrally coordinated sheet-like β-Zn(dca)2 and β-Co/Zn(dca)2, and the octahedrally coordinated rutile-like α-Co(dca)2, where dca‒ = dicyanamide, N(CN)2−, and magnetism of β-Co(dca)2 Chemical Communications, 1999, 177 |
| 7101048 | CIF | C6 H6 N9 Yb | P m -3 m | 6.788; 6.788; 6.788 90; 90; 90 | 312.77 | Klaus Muller-Buschbaum; Yassin Mokaddem 3-Dimensional Networks of Lanthanide 1,2,4-Triazolates: 3-infinite[Yb(Tz)3] and 3-infinite[Eu2(Tz)5(TzH)2], the First 4f Networks with Complete Nitrogen Coordination Chemical Communications, 2006 |
| 7111361 | CIF | C6 H7 N S | P 1 c 1 | 7.2305; 5.8513; 7.7552 90; 107.364; 90 | 313.15 | Jetti, Ram K. R.; Boese, Roland; Thakur, Tejender S.; Vangala, Venu R.; Desiraju, Gautam R. Proton transfer and N(+)?H?S(?) hydrogen bonds in the crystal structure of 4-aminothiophenol Chemical Communications, 2004, 2526-2527 |
| 7125482 | CIF | C4 H12 Au N | P 4/n m m :2 | 7.599; 7.599; 5.433 90; 90; 90 | 313.7 | Dietzel, P. D.; Jansen, M. Synthesis and crystal structure determination of tetramethylammonium auride. Chemical communications (Cambridge, England), 2001, 2208-2209 |
| 7107435 | CIF | C12 H10 Br2 Cd N2 | P -1 | 3.91426; 8.8696; 9.4343 79.568; 86.28; 86.248 | 320.97 | Mangayarkarasi Nagarathinam; Anjana Chanthapally; Saul Lapidus; Peter W. Stephens; Jagadese J. Vittal Mechanochemical Reactions of Coordination Polymers by Grinding with KBr Chem.Commun., 2012, 48, 2585 |
| 7127078 | CIF | F I O3 Zn | P 1 21/n 1 | 5.0197; 5.2136; 12.4572 90; 95.943; 90 | 324.26 | Cao, Liling; Luo, Min; Lin, Chensheng; Zhou, Yuqiao; Zhao, Dan; Yan, Tao; Ye, Ning From centrosymmetric to noncentrosymmetric: intriguing structure evolution in d<sup>10</sup>-transition metal iodate fluorides. Chemical communications (Cambridge, England), 2020, 56, 10734-10737 |
| 7110462 | CIF | C3 H6 O | C m c m | 6.1219; 5.2029; 10.244 90; 90; 90 | 326.29 | Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay The influence of pressure and temperature on the crystal structure of acetone Chemical Communications, 1999, 751 |
| 7103193 | CIF | C H3 Ag N2 | P b c m | 3.9034; 15.7268; 5.3245 90; 90; 90 | 326.86 | Chippindale, Ann M; Head, Laura E; Hibble, Simon J Simple linear asymmetrical complexes of silver(I): NC-Ag-NH3 and Br-Ag-NH3. Chemical communications (Cambridge, England), 2008, 3010-3012 |
| 7116635 | CIF | C16 H4 Cl2 N4 | P -1 | 4.7573; 7.941; 8.892 92.898; 100.56; 94.347 | 328.6 | Shuaijun Yang; Danqing Liu; Xiaomin Xu; Qian Miao Molecular packing and n-channel thin film transistors of chlorinated cyclobuta[1,2-b:3,4-b']diquinoxalines Chem.Commun., 2015, 51, 4275 |
| 7127576 | CIF | C15 H13 N3 O3 | P 1 | 5.0971; 5.3649; 12.3429 99.966; 96.111; 90.897 | 330.34 | Saha, Debarshi; Taily, Irshad Maajid; Naik, Sumitra; Banerjee, Prabal Electrochemical access to benzimidazolone and quinazolinone derivatives <i>via in situ</i> generation of isocyanates. Chemical communications (Cambridge, England), 2021, 57, 631-634 |
| 7117507 | CIF | Cl Hf N Na0.25 | R -3 m :H | 3.587907; 3.587907; 29.67848 90; 90; 120 | 330.868 | Oro-Sole, J.; Frontera, C.; Martinez, B.; Beltran-Porter, D.; Fuertes, A.; Palacin, M.R. A new intermediate intercalate in superconducting sodium-doped hafnium nitride chloride Chemical Communications, 2005, 2005, 3352-3354 |
| 7103194 | CIF | C H3 Ag N2 | C m c m | 3.9543; 15.9183; 5.2689 90; 90; 90 | 331.65 | Chippindale, Ann M; Head, Laura E; Hibble, Simon J Simple linear asymmetrical complexes of silver(I): NC-Ag-NH3 and Br-Ag-NH3. Chemical communications (Cambridge, England), 2008, 3010-3012 |
| 7131418 | CIF | C10 H14 Cl2 Mo O4 | P -1 | 7.2362; 7.3583; 7.9687 92.355; 112.501; 118.207 | 332.36 | Masero, Fabio; Mougel, Victor Molybdenum(IV) β-diketonate complexes as highly active catalysts for allylic substitution reactions. Chemical communications (Cambridge, England), 2023, 59, 4636-4639 |
| 7112816 | CIF | C8 H4 N2 O | P -1 | 7.0278; 7.2916; 7.6914 117.269; 90.138; 106.131 | 332.64 | Fatila, Elisabeth M.; Goodreid, Jordan; Clérac, Rodolphe; Jennings, Michael; Assoud, Jalil; Preuss, Kathryn E. High-spin supramolecular pair of Mn(II)/thiazyl radical complexes. Chemical communications (Cambridge, England), 2010, 46, 6569-6571 |
| 7100788 | CIF | C12 H16 O6 | P -1 | 4.1673; 6.5063; 12.4424 97.557; 92.948; 91.67 | 333.77 | Roger Davey; G. Dent; S. Parveen Linking solution chemistry to crystal nucleation:the case of tetrolic acid Chemical Communications, 2005 |
| 7122341 | CIF | C14 H14 Cl2 N2 O2 | P -1 | 4.4516; 6.7274; 11.4945 86.957; 83.772; 77.68 | 334.16 | Kolesnichenko, Igor V.; Escamilla, P. Rogelio; Michael, Jason A.; Lynch, Vincent M.; Vanden Bout, David A.; Anslyn, Eric V. Hydrogen peroxide production via a redox reaction of N,N'-dimethyl-2,6-diaza-9,10-anthraquinonediium by addition of bisulfite. Chemical communications (Cambridge, England), 2018, 54, 11204-11207 |
| 7110440 | CIF | O5 S2 Sm2 Ti2 | I 4/m m m | 3.818; 3.818; 22.952 90; 90; 90 | 334.57 | Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W. Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases Chemical Communications, 1999, 979 |
| 7130351 | CIF | C12 Br3 Rb | P m -3 m | 6.944; 6.944; 6.944 90; 90; 90 | 334.834 | Han, Keke; Zhang, Mengxia; Wei, Zhenhong; Ye, Xing; Rao, Wenjun; Zhang, Haina; Cai, Hu Precise design and preparation of two 3D organic−inorganic perovskite ferroelectrics (1,5-diazabicyclo[3.2.2]nonane)RbX3 (X = Br, I) Chemical Communications, 2022 |
| 7121335 | CIF | C7 H4 Br N | C 1 m 1 | 9.509; 8.535; 4.127 90; 90.311; 90 | 334.9 | Alimi, Lukman O.; Lama, Prem; Smith, Vincent J.; Barbour, Leonard J. Hand-twistable plastically deformable crystals of a rigid small organic molecule. Chemical communications (Cambridge, England), 2018, 54, 2994-2997 |
| 7101565 | CIF | C6 H12 N6 O10 Zn | P -1 | 6.3661; 7.5923; 8.0357 103.58; 103.119; 109.693 | 334.98 | I.Gural'skiy; P.V.Solntsev; H.Krautscheid; K.V.Domasevitch Metal-organic frameworks exhibiting strong anion-pi interactions Chemical Communications, 2006 |
| 7127999 | CIF | O4 S3 Tm2 Zr2 | P b a m | 6.4784; 14.1361; 3.6618 90; 90; 90 | 335.35 | Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer. Chemical communications (Cambridge, England), 2021, 57, 3500-3503 |
| 7122726 | CIF | C2 H5 O6 P2 Sb | P -1 | 4.6984; 4.9701; 15.6294 83.332; 83.799; 68.098 | 335.51 | Yin, Jinlin; Zhang, Guiyang; Peng, Chengdong; Fei, Honghan An Ultrastable Metal-Organic Material Emits Effcient and Broadband Bluish White-Light Emission for Luminescent Thermometer Chemical Communications, 2018 |
| 7121334 | CIF | C7 H4 Br N | C 1 m 1 | 9.531; 8.5593; 4.1352 90; 90.295; 90 | 337.34 | Alimi, Lukman O.; Lama, Prem; Smith, Vincent J.; Barbour, Leonard J. Hand-twistable plastically deformable crystals of a rigid small organic molecule. Chemical communications (Cambridge, England), 2018, 54, 2994-2997 |
| 7118967 | CIF | C7 H3 Cl F2 O | P -1 | 6.859; 7.2006; 8.0365 94.613; 104.275; 115.906 | 337.85 | Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra 'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids Chem.Commun., 2016, 52, 7225 |
| 7128501 | CIF | Ga2 H2 O9 S Te | P 1 21/m 1 | 4.9825; 9.7519; 6.9741 90; 93.55; 90 | 338.21 | Li, Peng-Fei; Hu, Chun-Li; Gong, Ya-Ping; Kong, Fang; Mao, Jiang-Gao Hg<sub>3</sub>(Te<sub>3</sub>O<sub>8</sub>)(SO<sub>4</sub>): a new sulfate tellurite with a novel structure and large birefringence explored from d<sup>10</sup> metal compounds. Chemical communications (Cambridge, England), 2021, 57, 7039-7042 |
| 7127998 | CIF | Hf2 O4 S3 Y2 | P b a m | 6.5013; 14.177; 3.671 90; 90; 90 | 338.35 | Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer. Chemical communications (Cambridge, England), 2021, 57, 3500-3503 |
| 7120256 | CIF | C2 H0 Cu2 O6 S | P 1 21/m 1 | 5.6115; 6.0587; 10.068 90; 93.612; 90 | 341.62 | Yang, Huimin; Fei, Honghan Exfoliation of a Two-Dimensional Cationic Inorganic Network as a New Paradigm for High-Capacity CrVI-Anion Capture Chem. Commun., 2017 |
| 7110441 | CIF | Nd2 O5 S2 Ti2 | I 4/m m m | 3.849; 3.849; 23.064 90; 90; 90 | 341.69 | Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W. Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases Chemical Communications, 1999, 979 |
| 7100432 | CIF | C17 H16 O4 | P 1 | 4.709; 8.2955; 9.1628 92.006; 94.865; 104.989 | 343.9 | Jonathan L. Sessler; Thomas Kohler; Vincent Lynch; David Sanchez-Garcia; Daniel Seidel Straightforward synthesis of sulfur bridged oligopyrrolic macrocycles Chemical Communications, 2005 |
| 7105588 | CIF | C16 H10 Hg N4 O2 | P -1 | 4.5549; 7.5368; 10.6347 106.904; 96.962; 94.24 | 344.43 | King, Kelsey N.; McNeil, Anne J. Streamlined approach to a new gelator: inspiration from solid-state interactions for a mercury-induced gelation Chemical Communications, 2010, 46, 3511 |
| 7129651 | CIF | C12 Mn3 O22.2 Rb2 | P 6/m m m | 7.851; 7.851; 6.462 90; 90; 120 | 344.9 | Wu, Xiaoyu; Wu, Haowei; Wu, Sicheng; Sun, Yimeng; Zhu, Jia; Zou, Ye; Xu, Wei; Zhu, Daoben Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions Chemical Communications, 2022 |
| 7110442 | CIF | O5 Pr2 S2 Ti2 | I 4/m m m | 3.871; 3.871; 23.036 90; 90; 90 | 345.19 | Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W. Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases Chemical Communications, 1999, 979 |
| 7111399 | CIF | C4 H6 Cd O6 | P -1 | 6.757; 7.544; 7.809 68.54; 86.53; 69.96 | 347.08 | Michaelides, Adonis; Skoulika, Stavroula; Siskos, Michael G. Assembly of a photoreactive coordination polymer containing rectangular grids Chemical Communications, 2004, 2418-2419 |
| 7127079 | CIF | Cd F I O3 | P 21 21 21 | 5.5051; 5.7913; 10.9326 90; 90; 90 | 348.55 | Cao, Liling; Luo, Min; Lin, Chensheng; Zhou, Yuqiao; Zhao, Dan; Yan, Tao; Ye, Ning From centrosymmetric to noncentrosymmetric: intriguing structure evolution in d<sup>10</sup>-transition metal iodate fluorides. Chemical communications (Cambridge, England), 2020, 56, 10734-10737 |
| 7117794 | CIF | Ge La2 Mg O6 | R 3 :H | 5.5125; 5.5125; 13.3295 90; 90; 120 | 350.786 | Swaffer, M.; Slater, P.R.; Matsumura, T.; Kamiyama, T.; Gover, R.K.B.; Kanno, R. La2 Mg Ge O6 : a novel Ge based perovskite synthesised under ambient pressure Chemical Communications, 2002, 2002, 1776-1777 |
| 7107634 | CIF | C8.5 H6 Fe N7 Pt S0.5 | P 4/m m m | 7.191; 7.191; 6.802 90; 90; 90 | 351.73 | Francisco J. Munoz Lara; Ana B. Gaspar; Daniel Aravena; Eliseo Ruiz; M. Carmen Munoz; Masaaki Ohba; Ryo Ohtani; Susumu Kitagawa; Jose A. Real Enhanced bistability by guest inclusion in Fe(II) spin crossover porous coordination polymers Chem.Commun., 2012, 48, 4686 |
| 7107635 | CIF | C8.5 H6 Fe N7 Pd S0.5 | P 4/m m m | 7.207; 7.207; 6.798 90; 90; 90 | 353.09 | Francisco J. Munoz Lara; Ana B. Gaspar; Daniel Aravena; Eliseo Ruiz; M. Carmen Munoz; Masaaki Ohba; Ryo Ohtani; Susumu Kitagawa; Jose A. Real Enhanced bistability by guest inclusion in Fe(II) spin crossover porous coordination polymers Chem.Commun., 2012, 48, 4686 |
| 7131465 | CIF | C6 H6 Cl N O2 | P 1 21/m 1 | 7.1749; 6.6728; 7.4888 90; 99.545; 90 | 353.58 | Li, Jie; Zhang, Tie; Lun, Meng-Meng; Su, Chang-Yuan; Zhang, Zhi-Xu; Huang, Pei-Zhi; Zhang, Yi; Teri, Gele; Fu, Da-Wei Nicotinic acid bromide: a simple organic salt optical-electrical ferroelastic with high <i>T</i><sub>c</sub>. Chemical communications (Cambridge, England), 2023, 59, 4644-4647 |
| 7125949 | CIF | C8 H9 N O | P -1 | 6.5511; 6.9192; 8.0265 93.73; 102.78; 91.769 | 353.68 | Zhai, Shengxian; Zhang, Xinping; Cheng, Bin; Li, Hui; Li, Yuntong; He, Yixuan; Li, Yun; Wang, Taimin; Zhai, Hongbin Synthesis of tetrasubstituted thiophenes via a [3+2] cascade cyclization reaction of pyridinium 1,4-zwitterionic thiolates and activated allenes. Chemical communications (Cambridge, England), 2020, 56, 3085-3088 |
| 7124079 | CIF | Cl Cu4 F H6 O6 | P 63/m m c | 6.672572; 6.672572; 9.18014 90; 90; 120 | 353.97 | Henderson, Alyssa May; Dong, Lianyang; Biswas, Sananda; Revell, Hannah; Xin, Yan; Valenti, Roser; Schlueter, John A.; Siegrist, Theo Order-Disorder Transition in the S = ½ Kagome Antiferromagnets Claringbullite and Barlowite Chemical Communications, 2019 |
| 7114820 | CIF | C10 H8 Co N6 O4 S2 | P -1 | 6.8922; 7.1528; 8.1074 82.49; 67.26; 74.06 | 354.31 | Sun, Hao-Ling; Ma, Bao-Qing; Gao, Song; Su, Gang Pyrazine dioxide bridged two-dimensional antiferromagnets [M(NCS)2(pzdo)2] (M = Mn, Co; pzdo = pyrazine dioxide)Electronic supplementary information (ESI) available: Fig. S1: two types of coordination mode for pzdo. Fig. S2: perspective view of compound 2 along the [010] direction. See http://www.rsc.org/suppdata/cc/b1/b107334f/ Chemical Communications, 2001, 2586 |
| 7132472 | CIF | C5 H4 N6 O2 | P 1 21 1 | 6.6812; 7.0171; 7.8472 90; 104.571; 90 | 356.06 | Balaraju, Muntha; Kommu, Nagarjuna; Vangara, Srinivas; Sahoo, Aswini K.; Thaltiri, Vikranth; Sahoo, Akhila K. Synthetic manifestation of trinitro-pyrazolo-2<i>H</i>-1,2,3-triazoles (TNPT) as insensitive energetic materials. Chemical communications (Cambridge, England), 2024, 60, 827-830 |
| 7110436 | CIF | C12 H12 Cu N2 O6 S2 | P -1 | 7.7242; 9.7417; 4.9584 103.837; 98.12; 93.227 | 357.07 | Kimura, Kentaro; Kimura, Takahiro; Kinoshita, Isamu; Nakashima, Nobuaki; Kitano, Ken’ichi; Nishioka, Takanori; Isobe, Kiyoshi Aerobic oxidation of a disulfide to its sulfonate leading to supramolecular pyridine-2-sulfonato Cu(II) and Zn(II) complexes Chemical Communications, 1999, 497 |
| 7125493 | CIF | C12 H18 Co N O7 | P -1 | 6.442; 7.007; 9.12 68.79; 89.06; 69.72 | 357.2 | Braga, D.; Cojazzi, G.; Emiliani, D.; Maini, L.; Grepioni, F. Reversible trapping of acid and base vapours into an amphoteric crystalline material. Chemical communications (Cambridge, England), 2001, 2272-2273 |
| 7117022 | CIF | C8 H10 N14 O4 | P -1 | 5.4207; 6.797; 10.53 82.822; 77.868; 71.33 | 358.65 | Jiaheng Zhang; Damon A. Parrish; Jean'ne M. Shreeve Curious cases of 3,6-dinitropyrazolo[4,3-c]pyrazole-based energetic cocrystals with high nitrogen content: an alternative to salt formation Chem.Commun., 2015, 51, 7337 |
| 7124080 | CIF | Br Cu4 F H6 O6 | P 63/m m c | 6.675463; 6.675463; 9.2989 90; 90; 120 | 358.86 | Henderson, Alyssa May; Dong, Lianyang; Biswas, Sananda; Revell, Hannah; Xin, Yan; Valenti, Roser; Schlueter, John A.; Siegrist, Theo Order-Disorder Transition in the S = ½ Kagome Antiferromagnets Claringbullite and Barlowite Chemical Communications, 2019 |
| 7102626 | CIF | C12 H12 Cu3 N8 | P -1 | 5.5367; 6.7153; 10.0436 105.55; 90.044; 90.586 | 359.74 | Huang, Xiao-Chun; Zhang, Jie-Peng; Lin, Yan-Yong; Yu, Xiao-Lan; Chen, Xiao-Ming Two mixed-valence copper(I,II) imidazolate coordination polymers: metal-valence tuning approach for new topological structures. Chemical communications (Cambridge, England), 2004, 1100-1101 |
| 7116636 | CIF | C16 H4 Cl4 N4 | P -1 | 5.8383; 6.0989; 10.5832 82.636; 76.077; 82.498 | 360.8 | Shuaijun Yang; Danqing Liu; Xiaomin Xu; Qian Miao Molecular packing and n-channel thin film transistors of chlorinated cyclobuta[1,2-b:3,4-b']diquinoxalines Chem.Commun., 2015, 51, 4275 |
| 7109769 | CIF | C17 H20 N2 O | P 1 | 6.0329; 7.7817; 9.0003 115.116; 101.212; 99.162 | 361.11 | Alberto Hernan-Gomez; Tyne D. Bradley; Alan R. Kennedy; Zoe Livingstone; Stuart D. Robertson; Eva Hevia Developing catalytic applications of cooperative bimetallics: competitive hydroamination/trimerization reactions of isocyanates catalysed by sodium magnesiates Chem.Commun., 2013, 49, 8659 |
| 7131467 | CIF | C12 H12 Br2 N2 O4 | P -1 | 7.07; 7.4103; 7.5264 79.944; 86.365; 68.488 | 361.21 | Li, Jie; Zhang, Tie; Lun, Meng-Meng; Su, Chang-Yuan; Zhang, Zhi-Xu; Huang, Pei-Zhi; Zhang, Yi; Teri, Gele; Fu, Da-Wei Nicotinic acid bromide: a simple organic salt optical-electrical ferroelastic with high <i>T</i><sub>c</sub>. Chemical communications (Cambridge, England), 2023, 59, 4644-4647 |
| 7112528 | CIF | C2 H9 N O6 P2 | P -1 | 5.578; 5.9177; 11.3992 82.368; 82.198; 78.166 | 362.72 | Chen, Shuo-ping; Hu, Le; Zhang, Yu-qin; Deng, Pu; Li, Cong; Chen, Xi; Yuan, Liang-jie (AEDPH3)·(BtaH): a novel supramolecular plaster with formaldehyde adsorption and formaldehyde/ultraviolet ray-induced luminescence switching performance. Chemical communications (Cambridge, England), 2012, 48, 552-554 |
| 7132415 | CIF | B4 O9 Pb Te | P -1 | 6.574; 6.7445; 9.8903 70.105; 78.877; 61.726 | 362.88 | Zhang, Ruonan; Tudi, Abudukadi; Yang, Xia; Wang, Xuping; Yang, Zhihua; Han, Shujuan; Pan, Shilie PbTeB<sub>4</sub>O<sub>9</sub>: a lead tellurium borate with unprecedented fundamental building block [B<sub>4</sub>O<sub>10</sub>] and large birefringence. Chemical communications (Cambridge, England), 2024, 60, 340-343 |
| 7122192 | CIF | C4 H6 N Np O6 | P m m n | 8.2246; 9.7709; 4.538 90; 90; 90 | 364.68 | Payne, Maurice K.; Pyrch, Mikaela; Jubinsky, Matthew; Basile, Madeline; Forbes, Tori Impacts of oxo interactions within actinyl metal organic materials: Highlight on thermal expansion behaviour Chemical Communications, 2018 |
| 7117792 | CIF | Bi2 Cu2 O4 Se2 Y | I 4/m m m | 3.86463; 3.86463; 24.428 90; 90; 90 | 364.841 | Evans, J.S.O.; Brogden, E.R.; Cordiner, R.L.; Thompson, A.L. Synthesis and characterisation of the new oxyselenide Bi2 Y O4 Cu2 Se2 Chemical Communications, 2002, 2002, 912-913 |
| 7119568 | CIF | C5 H13 N O S | P 1 21/m 1 | 6.2849; 8.8158; 6.6483 90; 96.781; 90 | 365.78 | Lohier, Jean-François; Glachet, Thomas; Marzag, Hamid; Gaumont, Annie-Claude; Reboul, Vincent Mechanistic investigation of the NH-sulfoximination of sulfide. Evidence for λ(6)-sulfanenitrile intermediates. Chemical communications (Cambridge, England), 2017, 53, 2064-2067 |
| 7114819 | CIF | C10 H8 Mn N6 O4 S2 | P -1 | 6.9405; 7.1938; 8.2566 82.237; 66.892; 74.971 | 365.94 | Sun, Hao-Ling; Ma, Bao-Qing; Gao, Song; Su, Gang Pyrazine dioxide bridged two-dimensional antiferromagnets [M(NCS)2(pzdo)2] (M = Mn, Co; pzdo = pyrazine dioxide)Electronic supplementary information (ESI) available: Fig. S1: two types of coordination mode for pzdo. Fig. S2: perspective view of compound 2 along the [010] direction. See http://www.rsc.org/suppdata/cc/b1/b107334f/ Chemical Communications, 2001, 2586 |
| 7132970 | CIF | Fe Nb Te2 | P 1 21/c 1 | 7.28; 6.305; 7.992 90; 92.33; 90 | 366.5 | Stepanova, Anna V.; Mironov, Andrei; Bogach, Alexey; Azarevich, Andrey; Presniakov, Igor A.; Sobolev, Alexey V.; Pankratov, Denis A.; Zayakhanov, Vladimir; Starchikov, Sergey; Verchenko, Valeriy; Shevelkov, Andrei V. Bulk ferromagnetism in cleavable van der Waals telluride NbFeTe2 Chemical Communications, 2024 |
| 7115450 | CIF | C15 H12 Br F N2 O4 | P 1 | 5.6907; 7.4227; 9.3653 108.137; 100.781; 90.415 | 368.39 | Jacek Kwiatkowski; Yixin Lu Asymmetric Michael addition of alpha-fluoro-alpha-nitroalkanes to nitroolefins: facile preparation of fluorinated amines and tetrahydropyrimidines Chem.Commun., 2014, 50, 9313 |
| 7130681 | CIF | C15 H16 Cl2 N2 O2 | P 1 | 4.8117; 5.783; 13.449 84.087; 87.255; 83.055 | 369.27 | Xu, Xinyue; Chen, Zehang; Lei, yunxiang; Sun, Xinyu; Liu, Miaochang; Wu, Huayue; Huang, Xiaobo Guest-activated Quaternary Ammonium Salt Hosts Emit Room Temperature Phosphorescence Chemical Communications, 2022 |
| 7126458 | CIF | C6 H11 F O4 | P 1 21 1 | 8.1522; 4.739; 9.7711 90; 99.908; 90 | 371.86 | Valverde, Pablo; Vendeville, Jean-Baptiste; Hollingsworth, Kristian; Mattey, Ashley P.; Keenan, Tessa; Chidwick, Harriet; Ledru, Helene; Huonnic, Kler; Huang, Kun; Light, Mark E.; Turner, Nicholas; Jiménez-Barbero, Jesús; Galan, M. Carmen; Fascione, Martin A.; Flitsch, Sabine; Turnbull, W. Bruce; Linclau, Bruno Chemoenzymatic synthesis of 3-deoxy-3-fluoro-l-fucose and its enzymatic incorporation into glycoconjugates. Chemical communications (Cambridge, England), 2020, 56, 6408-6411 |
| 7129653 | CIF | C12 Cs2 Mn3 O17.94 | P 6/m m m | 7.844; 7.844; 6.985 90; 90; 120 | 372.2 | Wu, Xiaoyu; Wu, Haowei; Wu, Sicheng; Sun, Yimeng; Zhu, Jia; Zou, Ye; Xu, Wei; Zhu, Daoben Chemical structure modulation in conductive MOFs by adjusting the oxidation state of the ligand and introducing alkali metal ions Chemical Communications, 2022 |
| 7117671 | CIF | C8 H8 F6 N4 Ni O2 Si | P 4/m m m | 7.0148; 7.0148; 7.5655 90; 90; 90 | 372.28 | Osama Shekhah; Youssef Belmabkhout; Karim Adil; Prashant M. Bhatt; Amy J. Cairns; Mohamed Eddaoudi A facile solvent-free synthesis route for the assembly of a highly CO2 selective and H2S tolerant NiSIFSIX metal-organic framework Chem.Commun., 2015, 51, 13595 |
| 7114069 | CIF | C16 H6 F10 N2 | P -1 | 6.3833; 7.7232; 8.2726 91.79; 107.64; 103.1 | 376.34 | Gordon, John C.; Shukla, Piyush; Cowley, Alan H.; Jones, Jamie N.; Keogh, D. Webster; Scott, Brian L. Dialkyl aluminium amides: new reagents for the conversion of C???O into C???NR functionalitiesElectronic supplementary information (ESI) available: HRMS, 1H and 19F NMR data for 1???9. See http://www.rsc.org/suppdata/cc/b2/b203693b/ Chemical Communications, 2002, 2710 |
| 7126195 | CIF | C8 H12 N6 O8 U | P -1 | 7.5785; 7.5951; 7.6538 117.032; 102.909; 92.179 | 377.53 | Kelley, Steven P.; Smetana, Volodymyr; Emerson, Stephen D.; Mudring, Anja-Verena; Rogers, Robin D. Benchtop access to anhydrous actinide N-donor coordination complexes using ionic liquids. Chemical communications (Cambridge, England), 2020, 56, 4232-4235 |
| 7110463 | CIF | C3 H6 O | C m c m | 6.514; 5.4159; 10.756 90; 90; 90 | 379.5 | Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay The influence of pressure and temperature on the crystal structure of acetone Chemical Communications, 1999, 751 |
| 7116227 | CIF | Al H5 Mg O10 P2 | P 1 21 1 | 5.0119; 7.769; 9.995 90; 102.595; 90 | 379.81 | Mu, Ying; Wang, Yanyan; Li, Yi; Li, Jiyang; Yu, Jihong Organotemplate-free synthesis of an open-framework magnesium aluminophosphate with proton conduction properties. Chemical communications (Cambridge, England), 2015, 51, 2149-2151 |
| 7106386 | CIF | C4 H10 B Cl N2 O | P -1 | 6.2785; 6.5034; 9.6048 83.088; 87.368; 78.44 | 381.34 | Jose M. Marquez; Elisa Martinez-Castro; Serena Gabrielli; Oscar Lopez; Ines Maya; Manuel Angulo; Eleuterio Alvarez; Jose G. Fernandez-Bolanos Alkoxyamine-cyanoboranes: efficient cyanoborane transfer agents Chem.Commun., 2011, 47, 5617 |
| 7120415 | CIF | F2 N2 O7 Pb2 | A m m 2 | 5.1684; 15.051; 4.9061 90; 90; 90 | 381.64 | Peng, Guang; Yang, Yi; Tang, Yu-Huan; Luo, Min; Yan, Tao; Zhou, Yuqiao; Lin, Chensheng; Lin, Zheshuai; Ye, Ning Collaborative Enhancement from Pb2+ and F- in Pb2(NO3)2(H2O)F2 Generates the Largest Second Harmonic Generation Effect Among Nitrates Chem. Commun., 2017 |
| 7110877 | CIF | C5 H15 Mo | I 4 | 7.68; 7.68; 6.49 90; 90; 90 | 382.8 | Roessler, Beatrice; Kleinhenz, Sven; Seppelt, Konrad Pentamethylmolybdenum Chemical Communications, 2000, 1039 |
| 7121875 | CIF | C14 H16 Cl2 N2 O6 | P -1 | 4.9143; 7.458; 11.698 73.27; 89.528; 69.737 | 383.2 | Donoshita, Masaki; Hayashi, Mikihiro; Ikeda, Ryuichi; Yoshida, Yukihiro; Morikawa, Shota; Sugimoto, Kunihisa; Kitagawa, Hiroshi Drastic rearrangement of self-assembled hydrogen-bonded tapes in a molecular crystal. Chemical communications (Cambridge, England), 2018, 54, 8571-8574 |
| 7125072 | CIF | C5 H12 N O P | P 1 21/m 1 | 5.941; 7.4092; 8.8324 90; 99.184; 90 | 383.8 | Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions. Chemical communications (Cambridge, England), 2016, 52, 11646-11648 |
| 7123215 | CIF | Bi6 Fe4.2 O18 Sc1.8 | R 3 c :H | 5.62949; 5.62949; 14.0273 90; 90; 120 | 384.984 | Khalyavin, Dmitry; Salak, Andrei; Frtman, Elena; Kotlyar, Oleksandr; Eardley, Edwin; Olekhnovich, N. M.; Pushkarev, Anatoli; Radyush, Yury; Fedorchenko, Alexey; Desnenko, Vladimir; Manuel, Pascal; Ding, Lei; Cizmar, Erik; Feher, Alexander Phenomenon of Conversion Polymorphism in Bi-Containing Metastable Perovskites Chemical Communications, 2019 |
| 7105696 | CIF | C12 H12 Co N10 O | P -1 | 3.5226; 9.6595; 11.578 100.01; 94.9; 92.32 | 385.93 | Zu0-Xi Li; Yong-Fei Zeng; Hong Ma; Xiai-He Bu A new 2D coordination polymer with an azide-bridged 1D homospin chain: C12 H12 Co N10 0 Chem.Commun., 2010, 46, 8540 |
| 7102704 | CIF | C10 H8 F8 I2 N2 | P -1 | 5.2447; 7.9197; 9.6803 84.078; 85.711; 75.147 | 386.09 | Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Stevenazzi, Andrea Metric engineering of perfluorocarbon-hydrocarbon layered solids driven by the halogen bonding. Chemical communications (Cambridge, England), 2004, 1492-1493 |
| 7119534 | CIF | O9 P2 Ti2 | P -1 | 5.08431; 8.6121; 9.6766 74.5011; 76.1455; 74.488 | 386.933 | García-Glez, Jorge; Amghouz, Zakariae; da Silva, Iván; Ania, Conchi O.; Parra, José B; Trobajo, Camino; García-Granda, Santiago The ability of a fibrous titanium oxophosphate for nitrogen-adsorption above room temperature. Chemical communications (Cambridge, England), 2017, 53, 2249-2251 |
| 7131466 | CIF | C6 H6 Br N O2 | P 1 21/m 1 | 7.4792; 6.9912; 7.5202 90; 100.036; 90 | 387.2 | Li, Jie; Zhang, Tie; Lun, Meng-Meng; Su, Chang-Yuan; Zhang, Zhi-Xu; Huang, Pei-Zhi; Zhang, Yi; Teri, Gele; Fu, Da-Wei Nicotinic acid bromide: a simple organic salt optical-electrical ferroelastic with high <i>T</i><sub>c</sub>. Chemical communications (Cambridge, England), 2023, 59, 4644-4647 |
| 7105442 | CIF | C9 H9 N O2 | P -1 | 7.264; 7.894; 8.328 104.845; 114.462; 103.622 | 387.21 | Smith, Keith; El-Hiti, Gamal A; Hegazy, Amany S One-pot synthesis of substituted isoindolin-1-ones via lithiation and substitution of N'-benzyl-N,N-dimethylureas. Chemical communications (Cambridge, England), 2010, 46, 2790-2792 |
| 7104547 | CIF | C6 H7 I O3 | P 1 21 1 | 6.368; 7.456; 8.308 90; 100.83; 90 | 387.4 | Boyd, Derek R; Sharma, Narain D; Malone, John F; Allen, Christopher C R New families of enantiopure cyclohexenone cis-diol, o-quinol dimer and hydrate metabolites from dioxygenase-catalysed dihydroxylation of phenols. Chemical communications (Cambridge, England), 2009, 34, 3633-3635 |
| 7111049 | CIF | C0.25 H0.25 N0.13 O0.38 W0.13 | I 4/m m m | 5.2288; 5.2288; 14.175 90; 90; 90 | 387.55 | Yan, Bangbo; Xu, Yan; Goh, Ngoh K.; Chia, Lian S. Hydrothermal synthesis and crystal structures of two novel hybrid open-frameworks and a two-dimensional network based on tungsten(vi) oxides Chemical Communications, 2000, 2169 |
| 7114917 | CIF | C6 H7 Br O4 | P -1 | 6.082; 6.329; 11.666 81.379; 88.407; 61.999 | 391.55 | Robinson, James J.; Buchanan, J. Grant; Kinsman, Richard G.; Mahon, Mary F.; Williams, Ian H.; Charlton, Michael H. Evidence for α-lactone intermediates in addition of aqueous bromine to disodium dimethyl-maleate and -fumarate Chemical Communications, 2001, 485 |
| 7127218 | CIF | C6 Cl Cu3 K4 N6 O6 | P -3 m 1 | 11.1833; 11.1833; 3.6304 90; 90; 120 | 393.21 | Kang, Kaijin; Liang, Fei; Meng, Xianghe; Tang, Jian; Zeng, Tixian; Xia, Mingjun; Lin, Zheshuai; Yin, Wenlong; Bin, Kang K<sub>4</sub>Cu<sub>3</sub>(C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sub>2</sub>X (X = Cl, Br): strong anisotropic layered semiconductors containing mixed p-p and d-p conjugated π-bonds. Chemical communications (Cambridge, England), 2020, 56, 12534-12537 |
| 7122593 | CIF | C12 H14 N2 P2 S4 | P -1 | 4.6979; 7.2032; 12.158 91.108; 99.021; 104.05 | 393.47 | Begum, Imtiaz; Schnakenburg, Gregor; Kelemen, Zsolt; Nyulászi, László; Boeré, René T; Streubel, Rainer Expanding the chemistry of ring-fused 1,4-diphosphinines by stable mono anion formation. Chemical communications (Cambridge, England), 2018, 54, 13555-13558 |
| 7121125 | CIF | C K3 O8 V | C 1 m 1 | 9; 9.297; 5.601 90; 122.89; 90 | 394 | Song, Yunxia; Luo, Min; Liang, Fei; Ye, Ning; Lin, Zheshuai The second-harmonic generation intensification derived from localization conjugated π-orbitals in O<sub>2</sub><sup>2</sup>. Chemical communications (Cambridge, England), 2018, 54, 1445-1448 |
| 7110523 | CIF | C Ag3 N3 O6 S | P -1 | 6.569; 7.732; 8.031 104.09; 93.94; 90.04 | 394.6 | Guo, Guo-Cong; Mak, Thomas C. W. Unprecedented μ-1,2,3κS:4,5κN coordination mode of the thiocyanate anion in two new double salts of silver(I), AgSCN·2AgNO3 and AgSCN·AgClO4 Chemical Communications, 1999, 813 |
| 7111225 | CIF | C8 H14 | P 1 21/c 1 | 9.321; 4.914; 8.7545 90; 99.51; 90 | 395.47 | Bond, Andrew D. C???H????? interactions in the low-temperature crystal structures of ??,??-unsaturated linear hydrocarbonsElectronic supplementary (ESI) information available: experimental details of crystal growth for 1???4, lattice-energy calculations for 1???4 and the n-alkanes, and definition and determination of the planar packing densities. See http://www.rsc.org/suppdata/cc/b2/b204261d/ Chemical Communications, 2002, 1664 |
| 7110878 | CIF | C5 H15 Ta | I 4 | 7.85; 7.85; 6.42 90; 90; 90 | 395.62 | Roessler, Beatrice; Kleinhenz, Sven; Seppelt, Konrad Pentamethylmolybdenum Chemical Communications, 2000, 1039 |
| 7121877 | CIF | C14 H16 Cl2 N2 O6 | P -1 | 4.6904; 8.921; 9.833 103.357; 96.447; 93.984 | 395.8 | Donoshita, Masaki; Hayashi, Mikihiro; Ikeda, Ryuichi; Yoshida, Yukihiro; Morikawa, Shota; Sugimoto, Kunihisa; Kitagawa, Hiroshi Drastic rearrangement of self-assembled hydrogen-bonded tapes in a molecular crystal. Chemical communications (Cambridge, England), 2018, 54, 8571-8574 |
| 7100428 | CIF | C6 H4 Cl N3 O4 | P 1 21 1 | 8.1619; 3.6646; 13.278 90; 91.31; 90 | 397.04 | C. Malla Reddy; Srinivas Basavoju; Gautam.Desiraju R Sorting of polymorphs based on mechanical properties. Trimorphs of 6-chloro-2,4-dinitroaniline Chemical Communications, 2005 |
| 7130259 | CIF | B Nd S3 | P n a 21 | 7.4818; 6.0037; 8.853 90; 90; 90 | 397.663 | Breton, Logan S.; Morrison, Gregory; Lacroix, Matthew; Halasyamani, P. Shiv; Zur Loye, Hans-Conrad Lanthanide Thioborates, an Emerging Class of Nonlinear Optical Materials, Efficiently Synthesized Using the Boron-Chalcogen Mixture Method Chemical Communications, 2022 |
| 7122255 | CIF | C8 H9 Cl N2 | P -1 | 5.5421; 7.9319; 9.4933 82.068; 76.113; 80.977 | 397.91 | Richards, Josh E.; Hooper, Alexander J. J.; Bayfield, Oliver W.; Cockett, Martin C. R.; Dear, Gordon J.; Holmes, A. Jonathon; John, Richard O.; Mewis, Ryan E.; Pridmore, Natalie; Roberts, Andy D.; Whitwood, Adrian C.; Duckett, Simon B. Using hyperpolarised NMR and DFT to rationalise the unexpected hydrogenation of quinazoline to 3,4-dihydroquinazoline. Chemical communications (Cambridge, England), 2018, 54, 10375-10378 |
| 7110482 | CIF | C18 H12 Cr F6 | P -1 | 7.3254; 9.2627; 6.6102 100.026; 112.327; 97.532 | 398.87 | Aspley, Catherine J.; Boxwell, Clive; Buil, Maria L.; Higgitt, Catherine L.; Perutz, Robin N.; Long, Conor A new combination of donor and acceptor: bis(η6-benzene)chromium and hexafluorobenzene form a charge-transfer stacked crystal Chemical Communications, 1999, 1027 |
| 7121103 | CIF | C16 H30 N2 O2 | P -1 | 4.8725; 5.548; 16.422 85.972; 89.944; 64.398 | 399.1 | Roy, Arundhati; Gautam, Amitosh; Malla, Javid Ahmad; Sarkar, Sohini; Mukherjee, Arnab; Talukdar, Pinaki Self-assembly of small-molecule fumaramides allows transmembrane chloride channel formation. Chemical communications (Cambridge, England), 2018, 54, 2024-2027 |
| 7112828 | CIF | C6 H9 F3 O3 | P 1 | 6.373; 6.623; 10.22 88.89; 72.96; 75.9 | 399.4 | Bresciani, Stefano; Lebl, Tomas; Slawin, Alexandra M. Z.; O'Hagan, David Fluorosugars: synthesis of the 2,3,4-trideoxy-2,3,4-trifluoro hexose analogues of D-glucose and D-altrose and assessment of their erythrocyte transmembrane transport. Chemical communications (Cambridge, England), 2010, 46, 5434-5436 |
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