Crystallography Open Database
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COD ID ![]() |
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7132978 | CIF | C97 H203 Ag45 Nb6 O47 S23 | P b c a | 28.7435; 28.3372; 48.7703 90; 90; 90 | 39723.9 | Zhao, Zichen; Zhao, Mengyun; Deng, Lan; Li, Qing; Zhang, Jing; Su, Hai-Feng; Lv, Hongjin; Yang, Guo-Yu Two structurally new Lindqvist hexaniobate-templated silver thiolate clusters Chemical Communications, 2024 |
7132979 | CIF | C82 H210 Ag41 K Nb6 O42.5 S26.5 | P 42 21 2 | 32.1512; 32.1512; 17.6732 90; 90; 90 | 18268.8 | Zhao, Zichen; Zhao, Mengyun; Deng, Lan; Li, Qing; Zhang, Jing; Su, Hai-Feng; Lv, Hongjin; Yang, Guo-Yu Two structurally new Lindqvist hexaniobate-templated silver thiolate clusters Chemical Communications, 2024 |
7132980 | CIF | C32 H72 Cu2 I4 P2 | P -1 | 12.4248; 12.9746; 16.828 86.253; 75.221; 64.491 | 2364.3 | Delafoulhouze, Jérémy; Cordier, Marie; Mevellec, Jean-Yves; Massuyeau, Florian; Hernandez, Olivier; Latouche, Camille; Perruchas, Sandrine Mechanoresponsive luminescence triggered by phase transition of a supercooled copper(I) complex. Chemical communications (Cambridge, England), 2024 |
7132981 | CIF | C8 H3 O5 Ti | I 41 2 2 | 15.1203; 15.1203; 11.9863 90; 90; 90 | 2740.35 | Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; crawshaw, danielle; Guo, Lixia; Ma, Yujie; kippax-jones, meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudic, Svemir; Frogley, Mark David; Schroder, Martin; Yang, Sihai High adsorption of ammonia in a titanium–based metal-organic framework Chemical Communications, 2024 |
7132982 | CIF | C8 H3 D1.25 N0.42 O5 Ti | I 41 2 2 | 15.0507; 15.0507; 12.0595 90; 90; 90 | 2731.8 | Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; crawshaw, danielle; Guo, Lixia; Ma, Yujie; kippax-jones, meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudic, Svemir; Frogley, Mark David; Schroder, Martin; Yang, Sihai High adsorption of ammonia in a titanium–based metal-organic framework Chemical Communications, 2024 |
7132983 | CIF | C8 H3 D3.82 N1.27 O5 Ti | I 41 2 2 | 14.92; 14.92; 12.1536 90; 90; 90 | 2705.47 | Zeng, Xiangdi; Li, Jiangnan; He, Meng; Lu, Wanpeng; crawshaw, danielle; Guo, Lixia; Ma, Yujie; kippax-jones, meredydd; Cheng, Yongqiang; Manuel, Pascal; Rudic, Svemir; Frogley, Mark David; Schroder, Martin; Yang, Sihai High adsorption of ammonia in a titanium–based metal-organic framework Chemical Communications, 2024 |
7132984 | CIF | C36 H32 N2 O11 Pb2 | P 1 21/n 1 | 16.46; 11.3441; 19.5207 90; 94.325; 90 | 3634.6 | Luo, Qi; Li, yuxia; Huang, Xin; Zheng, Yi; Wang, Shuaihua; Gu, Qi; Wu, Shao-Fan Tetraphenylene-based semiconductive metal–organic framework crystals for direct X-ray detection and imaging Chemical Communications, 2024 |
7132985 | CIF | C19 H15 Cl2 N O3 | P 1 21/c 1 | 16.1234; 11.9822; 8.9939 90; 94.945; 90 | 1731.1 | Harsha, Harsha; Kumar, Rohit; Jain, Nidhi 1O2 mediated synthesis of carbonyl substituted quinoline-2,4(1H,3H)-diones in visible light: 4CzIPN as a reusable photocatalyst Chemical Communications, 2024 |
7132986 | CIF | C148 H188 F12 Fe2 N18 O28 S4 | P 1 21/m 1 | 16.4651; 23.3184; 17.2067 90; 97.467; 90 | 6550.3 | Mobili, Riccardo; Preda, Giovanni; Dondi, Daniele; Monzani, Enrico; Vadivel, Dhanalakshmi; Massera, Chiara; Pasini, Dario; Amendola, Valeria Triptycene-based diiron(II) mesocate: spin-crossover in solution Chemical Communications, 2024 |
7132987 | CIF | C246 H340 F12 N34 O33 P2 | P -1 | 21.5297; 24.7451; 29.6954 109.868; 104.145; 101.331 | 13733.1 | Huang, Song; Wang, Zhenwen; Wu, Jinyang; Mai, Xinyan; Qin, Song; Zhou, Yuqiao; Yuan, Daqiang; Li, Xiaowei; Feng, Wen; Yuan, Lihua A molecular sheaf: doubly threaded [6]rotaxane Chemical Communications, 2024 |
7132988 | CIF | C16 H24 Au B3 F12 N8 | C 1 2/c 1 | 15.3073; 15.711; 22.0225 90; 99.885; 90 | 5217.63 | Barwise, Lachlan; Moon, Lachlan; Dhakal, Bibidh; Hogan, Conor Francis; White, Keith Forrest; Dutton, Jason Laurence An extremely electron poor Au(III) trication bearing acetonitrile ligands Chemical Communications, 2024 |
7132989 | CIF | C21 H29 Au B2 F8 N6 | P 1 21 1 | 9.4083; 19.422; 15.7483 90; 103.473; 90 | 2798.46 | Barwise, Lachlan; Moon, Lachlan; Dhakal, Bibidh; Hogan, Conor Francis; White, Keith Forrest; Dutton, Jason Laurence An extremely electron poor Au(III) trication bearing acetonitrile ligands Chemical Communications, 2024 |
7132990 | CIF | C198 H251 N6 O46 | P 1 21/n 1 | 22.4005; 26.9673; 32.2242 90; 90.916; 90 | 19463.5 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132991 | CIF | C152.46 H189.38 N6 O23.23 S13.23 | P -1 | 21.1953; 26.1285; 31.3285 73.564; 72.242; 68.045 | 15042 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132992 | CIF | C190 H208 N6 O58 | C 1 2/c 1 | 39.4383; 27.5839; 35.2015 90; 109.998; 90 | 35985.4 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132993 | CIF | C174 H256 N6 O34 S24 | P 63 2 2 | 19.9064; 19.9064; 33.451 90; 90; 120 | 11479.6 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132994 | CIF | C138 H148 N6 O16 S6 | P -1 | 21.6989; 27.1612; 27.6258 94.1928; 111.564; 109.903 | 13867 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132995 | CIF | C342 H393 N12 O80.01 | P -1 | 21.4803; 27.0745; 29.3858 94.133; 108.263; 112.968 | 14568.6 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132996 | CIF | C154.5 H176.5 N15.5 O19.5 | P -1 | 21.6013; 27.1502; 28.3933 93.864; 111.256; 110.441 | 14178.7 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132997 | CIF | C132 H130 N6 O13 S3 | I 1 2 1 | 51.7627; 21.7575; 57.0058 90; 90.443; 90 | 64199.5 | Shields, Caitlin Elise; Fellowes, Thomas; Slater, Anna Grace; Cooper, Andrew; Andrews, Keith G.; Szczypiński, Filip Tomasz Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation Chemical Communications, 2024 |
7132998 | CIF | C17 H10 F5 N3 | P 1 21/c 1 | 14.4065; 6.1767; 17.7705 90; 109.917; 90 | 1486.72 | Das, Animesh; Maji, Biplab Substrate-controlled divergent remote C-H and N-H polyfluoroarylation of 2-aminopyrimidines with polyfluoroarenes via Pd(II)/Pd(0) catalysis Chemical Communications, 2024 |
7132999 | CIF | C15 H14 F5 N3 | P 1 21/c 1 | 12.4951; 7.6806; 16.1712 90; 108.511; 90 | 1471.65 | Das, Animesh; Maji, Biplab Substrate-controlled divergent remote C-H and N-H polyfluoroarylation of 2-aminopyrimidines with polyfluoroarenes via Pd(II)/Pd(0) catalysis Chemical Communications, 2024 |
7133000 | CIF | C20 H20 Cl4 N4 Np | C 1 2/c 1 | 19.2449; 9.5303; 15.6081 90; 127.522; 90 | 2270.4 | Lopez, Lauren Marie; Uible, Madeleine; Bart, Suzanne Cathleen; Zeller, Matthias Lewis Base Adducts of NpCl4 Chemical Communications, 2024 |
7133001 | CIF | C8 H12 Cl4 N4 Np | C 1 2/c 1 | 14.6308; 8.4327; 13.7095 90; 91.687; 90 | 1690.71 | Lopez, Lauren Marie; Uible, Madeleine; Bart, Suzanne Cathleen; Zeller, Matthias Lewis Base Adducts of NpCl4 Chemical Communications, 2024 |
7133002 | CIF | C36 H30 Cl4 Np O2 P2 | P 1 21 1 | 9.9552; 15.3552; 11.9194 90; 98.955; 90 | 1799.84 | Lopez, Lauren Marie; Uible, Madeleine; Bart, Suzanne Cathleen; Zeller, Matthias Lewis Base Adducts of NpCl4 Chemical Communications, 2024 |
7133003 | CIF | C45.76 H67.53 Cl4 N4 Np O2.44 | P 1 21/n 1 | 16.6555; 11.535; 25.751 90; 94.5345; 90 | 4931.8 | Lopez, Lauren Marie; Uible, Madeleine; Bart, Suzanne Cathleen; Zeller, Matthias Lewis Base Adducts of NpCl4 Chemical Communications, 2024 |
7133004 | CIF | C18 H20 O3 | C 1 2/c 1 | 33.38; 5.972; 18.656 90; 119.978; 90 | 3221 | Kumar, Rakesh; Dutt, Shiv; Banerjee, Prabal Electrochemical oxidative C-C bond cleavage of methylenecyclopropanes with alcohols. Chemical communications (Cambridge, England), 2024, 60, 4246-4249 |
7133005 | CIF | C23 H22 N2 O | P c a 21 | 10.0123; 18.3467; 10.107 90; 90; 90 | 1856.58 | Kumar, Dharmendra; Unnikrishnan, Urmila; Kuram, Malleswara Rao Facile access to C-substituted piperazin-2-ones and mianserin derivative enabled by chemoselective carbene insertion and cyclization cascade Chemical Communications, 2024 |
7133006 | CIF | C9 H19 F3 N2 O4 S2 | P 1 21/c 1 | 9.52; 8.588; 18.645 90; 99.465; 90 | 1503.6 | Nakazono, Yosuke; Inoue, Ryota; Sumitani, Ryo; Mochida, Tomoyuki Solvent-free Transformation of Protic Ionic Liquids into Zwitterions Chemical Communications, 2024 |
7133007 | CIF | C9 H17 F3 N2 O4 S2 | P 1 21/c 1 | 8.664; 9.443; 17.044 90; 95.637; 90 | 1387.7 | Nakazono, Yosuke; Inoue, Ryota; Sumitani, Ryo; Mochida, Tomoyuki Solvent-free Transformation of Protic Ionic Liquids into Zwitterions Chemical Communications, 2024 |
7133008 | CIF | C10 H16 F3 N3 O4 S2 | P -1 | 9.869; 17.149; 18.682 93.615; 92.206; 94.036 | 3145 | Nakazono, Yosuke; Inoue, Ryota; Sumitani, Ryo; Mochida, Tomoyuki Solvent-free Transformation of Protic Ionic Liquids into Zwitterions Chemical Communications, 2024 |
7133009 | CIF | C45 H36 O9 | P b c m | 16.1779; 7.77835; 27.1947 90; 90; 90 | 3422.11 | Han, Ying; Guo, Wei-Chen; Du, Xu-Sheng; Chen, Chuan-Feng Synthesis and property of an O-doped aromatic belt Chemical Communications, 2024 |
7133010 | CIF | C39 H18 O3 | P 1 21/n 1 | 11.4275; 15.9886; 16.0325 90; 97.391; 90 | 2904.96 | Han, Ying; Guo, Wei-Chen; Du, Xu-Sheng; Chen, Chuan-Feng Synthesis and property of an O-doped aromatic belt Chemical Communications, 2024 |
7133011 | CIF | C58 H41 N3 | P 21 21 21 | 12.7061; 14.0855; 23.6488 90; 90; 90 | 4232.5 | Sharma, Priyank Kumar; Jana, Palash; Bandyopadhyay, Subhajit; Das, Soumyajit Cyano disubstituted tetrabenzoindeno[2,1-a]fluorene: open-shell or closed-shell? Chemical Communications, 2024 |
7133012 | CIF | C27 H42 N4 O5 Si | P 1 21/c 1 | 12.838; 15.169; 15.0877 90; 102.909; 90 | 2863.91 | Jeanmard, Laksamee; Lodovici, Giacomo; George, Ian; Bray, Joshua T. W.; Whitwood, Adrian Charles; Thomas, Gavin; Fairlamb, Ian J. S.; Unsworth, William Paul; Clarke, Paul Stereoselective synthesis of an advanced trans-decalin intermediate towards the total synthesis of anthracimycin Chemical Communications, 2024 |
7133013 | CIF | C17 H22 O5 | P 21 21 21 | 7.18006; 12.9367; 17.2317 90; 90; 90 | 1600.59 | Jeanmard, Laksamee; Lodovici, Giacomo; George, Ian; Bray, Joshua T. W.; Whitwood, Adrian Charles; Thomas, Gavin; Fairlamb, Ian J. S.; Unsworth, William Paul; Clarke, Paul Stereoselective synthesis of an advanced trans-decalin intermediate towards the total synthesis of anthracimycin Chemical Communications, 2024 |
7133014 | CIF | C94 H150 Mg N4 Ni2 O8 | P -1 | 10.3314; 12.155; 20.115 85.509; 76.039; 68.417 | 2279.4 | Wolff, Siad; Ponsonby, Annabelle; Dallmann, Andre; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian Appropriation of group II metals: Synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes Chemical Communications, 2024 |
7133015 | CIF | C67 H100 Mg N4 Ni O4 | P -1 | 11.7869; 13.1585; 21.6061 95.572; 101.159; 101.843 | 3184.9 | Wolff, Siad; Ponsonby, Annabelle; Dallmann, Andre; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian Appropriation of group II metals: Synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes Chemical Communications, 2024 |
7133016 | CIF | C86 H133 Ca N5 Ni2 O12 | P -1 | 13.1189; 18.636; 19.149 81.507; 86.676; 74.077 | 4451.9 | Wolff, Siad; Ponsonby, Annabelle; Dallmann, Andre; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian Appropriation of group II metals: Synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes Chemical Communications, 2024 |
7133017 | CIF | C96 H158 Mg N4 Ni2 O8 | P 1 21/c 1 | 28.041; 14.697; 24.348 90; 104.01; 90 | 9736 | Wolff, Siad; Ponsonby, Annabelle; Dallmann, Andre; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian Appropriation of group II metals: Synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes Chemical Communications, 2024 |
7133018 | CIF | C92 H150 Ca N4 Ni2 O12 | P 1 n 1 | 16.7438; 14.268; 20.0197 90; 97.276; 90 | 4744.2 | Wolff, Siad; Ponsonby, Annabelle; Dallmann, Andre; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian Appropriation of group II metals: Synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes Chemical Communications, 2024 |
7133019 | CIF | C18 H14 Cl N O | P 1 21/c 1 | 7.8569; 16.8285; 11.212 90; 104.254; 90 | 1436.81 | ., Sachin; Sharma, Tamanna; Chandra, Devesh; ., Sumit; Sharma, Upendra Inherent directing group enabled Co(III)-catalyzed C-H allylation/vinylation of isoquinolones Chemical Communications, 2024 |
7133020 | CIF | C62 H47 Cl3 N6 O10 P2 Ru2 | P 1 21/c 1 | 19.7908; 15.1911; 23.1446 90; 107.604; 90 | 6632.4 | Arya, Yogita; Ansari, Toufik; Bera, Sudip; Panda, Sanjib; Indra, Arindam; Lahiri, Goutam Kumar Superior electrocatalytic hydrogen evolution activity of a triply bridged diruthenium(II) complex on carbon cloth support Chemical Communications, 2024 |
7133021 | CIF | C24 H12 Br4 N6 | I 1 2/a 1 | 11.9288; 6.8445; 27.4989 90; 90.376; 90 | 2245.15 | Arya, Yogita; Ansari, Toufik; Bera, Sudip; Panda, Sanjib; Indra, Arindam; Lahiri, Goutam Kumar Superior electrocatalytic hydrogen evolution activity of a triply bridged diruthenium(II) complex on carbon cloth support Chemical Communications, 2024 |
7133022 | CIF | C56 H41 Br3 Cl4 N4 O6 P2 Ru | P 1 21/c 1 | 18.3915; 14.4654; 20.9301 90; 100.804; 90 | 5469.55 | Arya, Yogita; Ansari, Toufik; Bera, Sudip; Panda, Sanjib; Indra, Arindam; Lahiri, Goutam Kumar Superior electrocatalytic hydrogen evolution activity of a triply bridged diruthenium(II) complex on carbon cloth support Chemical Communications, 2024 |
7133023 | CIF | C58 H49 Cl N4 O6 P2 Ru | P -1 | 15.601; 21.105; 22.1703 110.152; 101.134; 99.661 | 6502.66 | Arya, Yogita; Ansari, Toufik; Bera, Sudip; Panda, Sanjib; Indra, Arindam; Lahiri, Goutam Kumar Superior electrocatalytic hydrogen evolution activity of a triply bridged diruthenium(II) complex on carbon cloth support Chemical Communications, 2024 |
7133024 | CIF | C40 H46 Cd N0.5 O17.5 S4 | P 1 21/n 1 | 10.722; 39.433; 14.317 90; 97; 90 | 6008 | Su, Jian; Han, Xiao; Ke, Si-Wen; Zhou, Xiaocheng; Yuan, Shuai; Ding, Mengning; Zuo, Jing-Lin Construction of a stable radical hydrogen−bonded metal−organic framework by functionalized tetrathiafulvalene linkers Chemical Communications, 2024 |
7133025 | CIF | C43 H59 B N4 Si | P -1 | 9.474; 13.9943; 16.2737 90.635; 90.829; 106.097 | 2072.54 | Chen, Wenhao; Hu, Haisheng; Feng, Jie; Zhu, Lei; Wu, Di Synthetic, Structural and Reactivity Studies of Boryl-Ethynyl Silylene Chemical Communications, 2024 |
7133026 | CIF | C57 H67 B N4 O2 Si | P 1 21/n 1 | 12.9587; 24.1745; 16.8361 90; 103.559; 90 | 5127.2 | Chen, Wenhao; Hu, Haisheng; Feng, Jie; Zhu, Lei; Wu, Di Synthetic, Structural and Reactivity Studies of Boryl-Ethynyl Silylene Chemical Communications, 2024 |
7133027 | CIF | C69 H75 B N4 O2 Si | C 1 c 1 | 11.765; 23.8074; 23.7692 90; 97.721; 90 | 6597.3 | Chen, Wenhao; Hu, Haisheng; Feng, Jie; Zhu, Lei; Wu, Di Synthetic, Structural and Reactivity Studies of Boryl-Ethynyl Silylene Chemical Communications, 2024 |
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