Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7226179 | CIF | C6 H8 O3 S | P 21 21 21 | 7.1126; 8.151; 25.807 90; 90; 90 | 1496.16 | Mangalum, A.; Boadi, F.; Masand, S. A.; Lalancette, R. A.; Pietrangelo, A. A Pb2±binding polychelatogen derived from thionated lactide RSC Adv., 2016, 6, 74250 |
| 7226180 | CIF | C11 H14 O3 S | P 21 21 21 | 7.7606; 10.8844; 12.686 90; 90; 90 | 1071.58 | Mangalum, A.; Boadi, F.; Masand, S. A.; Lalancette, R. A.; Pietrangelo, A. A Pb2±binding polychelatogen derived from thionated lactide RSC Adv., 2016, 6, 74250 |
| 7226181 | CIF | C6 H8 O2 S2 | P c a 21 | 12.8947; 8.5141; 7.3227 90; 90; 90 | 803.936 | Mangalum, A.; Boadi, F.; Masand, S. A.; Lalancette, R. A.; Pietrangelo, A. A Pb2±binding polychelatogen derived from thionated lactide RSC Adv., 2016, 6, 74250 |
| 7226195 | CIF | C7 H5 Br N4 O2 | P b c a | 7.169; 13.975; 18.344 90; 90; 90 | 1837.8 | Kumar, Arvind; Kumar, Satyanand; Khajuria, Yugal; Awasthi, Satish Kumar A comparative study between heterogeneous stannous chloride loaded silica nanoparticles and a homogeneous stannous chloride catalyst in the synthesis of 5-substituted 1H-tetrazole RSC Adv., 2016, 6, 75227 |
| 7226202 | CIF | C15 H14 O5 | P 1 21/n 1 | 3.8416; 25.1212; 12.9636 90; 92.567; 90 | 1249.8 | Rao, Maddali L. N.; Ramakrishna, Boddu S. Rh-catalyzed direct synthesis of 2,2′-dihydroxybenzophenones and xanthones RSC Adv., 2016, 6, 75505 |
| 7226223 | CIF | C19 H26 O4 | P 21 21 2 | 20.3794; 9.1072; 9.1422 90; 90; 90 | 1696.79 | Li, Xin; Li, Xiao-Ming; Li, Xiao-Dong; Xu, Gang-Ming; Liu, Yang; Wang, Bin-Gui 20-Nor-isopimarane cycloethers from the deep-sea sediment-derived fungus Aspergillus wentii SD-310 RSC Adv., 2016, 6, 75981 |
| 7226224 | CIF | C19 H28 O4 | P 21 21 21 | 6.2051; 8.201; 34.011 90; 90; 90 | 1730.8 | Li, Xin; Li, Xiao-Ming; Li, Xiao-Dong; Xu, Gang-Ming; Liu, Yang; Wang, Bin-Gui 20-Nor-isopimarane cycloethers from the deep-sea sediment-derived fungus Aspergillus wentii SD-310 RSC Adv., 2016, 6, 75981 |
| 7226225 | CIF | C19 H26 O4 | P 1 21 1 | 11.1182; 12.8745; 11.7116 90; 90.398; 90 | 1676.4 | Li, Xin; Li, Xiao-Ming; Li, Xiao-Dong; Xu, Gang-Ming; Liu, Yang; Wang, Bin-Gui 20-Nor-isopimarane cycloethers from the deep-sea sediment-derived fungus Aspergillus wentii SD-310 RSC Adv., 2016, 6, 75981 |
| 7226254 | CIF | Ga2.4 Ge1.6 K2.4 Se8 | I 4/m c m | 8.1208; 8.1208; 6.208 90; 90; 90 | 409.4 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226255 | CIF | Ga2.4 K2.4 Se8 Si1.6 | I 4/m c m | 8.1999; 8.1999; 6.146 90; 90; 90 | 413.25 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226256 | CIF | Ga2.4 Ge1.6 K2.4 S8 | I 4/m c m | 7.8824; 7.8824; 5.9557 90; 90; 90 | 370.04 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226257 | CIF | Ga2.4 K2.4 S8 Si1.6 | I 4/m c m | 7.891; 7.891; 5.866 90; 90; 90 | 365.26 | He, Jianqiao; Zhang, Xian; Guo, Pan; Cheng, Ye; Zheng, Chong; Huang, Fuqiang Synthesis, structure, and optical properties of K2.4Ga2.4M1.6Q8(M = Si, Ge; Q = S, Se) crystals and glasses RSC Adv., 2016, 6, 76789 |
| 7226271 | CIF | C22 H23 N3 O4 | P 21 21 21 | 8.2009; 11.6802; 21.3811 90; 90; 90 | 2048.06 | Amireddy, Mamatha; Chen, Kwunmin Organocatalytic one-pot asymmetric synthesis of functionalized spiropyrazolones via a Michael-aldol sequential reaction RSC Adv., 2016, 6, 77474 |
| 7226335 | CIF | C14 H11 N O4 | P 1 21/c 1 | 8.093; 13.179; 11.412 90; 91.431; 90 | 1216.8 | Vaz, Wesley F.; Custodio, Jean M. F.; Silveira, Rafael G.; Castro, Adailton N.; Campos, Carlos E. M.; Anjos, Murilo M.; Oliveira, Guilherme R.; Valverde, Clodoaldo; Baseia, Basílio; Napolitano, Hamilton B. Synthesis, characterization, and third-order nonlinear optical properties of a new neolignane analogue RSC Adv., 2016, 6, 79215 |
| 7226398 | CIF | C16 H15 N O5 | P 1 21/c 1 | 8.3195; 13.6469; 12.8427 90; 90; 90 | 1458.1 | Bautista Maezono, Shizuka Mei; Poudel, Tej Narayan; Xia, Likai; Lee, Yong Rok A green synthetic approach to synthesizing diverse 2-pyridones for their exceptional UV shielding functions RSC Adv., 2016, 6, 82321 |
| 7226399 | CIF | C24 H38 Br N O7 | P 21 21 21 | 7.0251; 11.3852; 32.308 90; 90; 90 | 2584.1 | Wang, Hao; Dai, Haofu; Heering, Christian; Janiak, Christoph; Lin, Wenhan; Orfali, Raha S.; Müller, Werner E. G.; Liu, Zhen; Proksch, Peter Targeted solid phase fermentation of the soil dwelling fungus Gymnascella dankaliensis yields new brominated tyrosine-derived alkaloids RSC Adv., 2016, 6, 81685 |
| 7226400 | CIF | C22 H18 N4 O7 S2 | P -1 | 9.516; 10.397; 12.669 66.973; 71.019; 89.378 | 1081 | Du, Jonathan J.; Váradi, Linda; Williams, Peter A.; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. An analysis of the experimental and theoretical charge density distributions of the piroxicam‒saccharin co-crystal and its constituents RSC Adv., 2016, 6, 81578 |
| 7226401 | CIF | C15 H13 N3 O4 S | P 1 21/c 1 | 7.034; 14.9894; 13.8939 90; 96.387; 90 | 1455.82 | Du, Jonathan J.; Váradi, Linda; Williams, Peter A.; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. An analysis of the experimental and theoretical charge density distributions of the piroxicam‒saccharin co-crystal and its constituents RSC Adv., 2016, 6, 81578 |
| 7226402 | CIF | C7 H5 N O3 S | P 1 21/c 1 | 9.444; 6.921; 11.684 90; 103.05; 90 | 743.965 | Du, Jonathan J.; Váradi, Linda; Williams, Peter A.; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. An analysis of the experimental and theoretical charge density distributions of the piroxicam‒saccharin co-crystal and its constituents RSC Adv., 2016, 6, 81578 |
| 7226481 | CIF | C13 H12 N2 O | P n a 21 | 9.1004; 10.5785; 11.775 90; 90; 90 | 1133.6 | Singh, Anoop S.; Kumar, Dhananjay; Mishra, Nidhi; Tiwari, Vinod K. An efficient one-pot synthesis of N,N′-disubstituted ureas and carbamates from N-acylbenzotriazoles RSC Adv., 2016, 6, 84512 |
| 7226482 | CIF | C7 H5 N O2 | P 21 21 21 | 4.4436; 6.641; 20.957 90; 90; 90 | 618.4 | Singh, Anoop S.; Kumar, Dhananjay; Mishra, Nidhi; Tiwari, Vinod K. An efficient one-pot synthesis of N,N′-disubstituted ureas and carbamates from N-acylbenzotriazoles RSC Adv., 2016, 6, 84512 |
| 7226483 | CIF | C44 H72 Br K9 N4 O37 S8 | P 1 21/c 1 | 17.9837; 13.1145; 32.7662 90; 102.828; 90 | 7534.9 | Cardona, Maria A.; Kveder, Marina; Baisch, Ulrich; Probert, Michael R.; Magri, David C. Water-soluble β-aminobisulfonate building blocks for pH and Cu2+indicators RSC Adv., 2016, 6, 84712 |
| 7226484 | CIF | C10 H17 K2 N O8 S2 | P n m a | 8.2498; 22.5592; 8.7439 90; 90; 90 | 1627.32 | Cardona, Maria A.; Kveder, Marina; Baisch, Ulrich; Probert, Michael R.; Magri, David C. Water-soluble β-aminobisulfonate building blocks for pH and Cu2+indicators RSC Adv., 2016, 6, 84712 |
| 7226485 | CIF | C28 H17 N O8 | P 1 21/c 1 | 8.2673; 18.169; 14.955 90; 91.962; 90 | 2245.1 | Dubovtsev, Alexey Yu.; Silaichev, Pavel S.; Nazarov, Mikhail A.; Dmitriev, Maksim V.; Maslivets, Andrey N.; Rubin, Michael Spiro-condensation of 5-methoxycarbonyl-1H-pyrrole-2,3-diones with cyclic enoles to form spiro substituted furo[3,2-c]-coumarins and quinolines RSC Adv., 2016, 6, 84730 |
| 7226486 | CIF | C31 H23 N3 O6 | P -1 | 10.048; 10.5278; 13.317 83.352; 74.653; 89.492 | 1349 | Dubovtsev, Alexey Yu.; Silaichev, Pavel S.; Nazarov, Mikhail A.; Dmitriev, Maksim V.; Maslivets, Andrey N.; Rubin, Michael Spiro-condensation of 5-methoxycarbonyl-1H-pyrrole-2,3-diones with cyclic enoles to form spiro substituted furo[3,2-c]-coumarins and quinolines RSC Adv., 2016, 6, 84730 |
| 7226490 | CIF | C185 H183.72 N15 O39 | P 1 21/c 1 | 24.9088; 7.7954; 22.8886 90; 103.302; 90 | 4325.1 | Liang, Lijuan; Zhao, Liancheng; Zeng, Xianshun Synthesis, optical, and chemical properties of a π-extended rhodol derivative and its derivatives with selectivity and sensitivity for sensing Hg2+in aqueous media RSC Adv., 2016, 6, 85165 |
| 7226496 | CIF | C11 H8 Cl4 O3 | P -1 | 6.5579; 7.6349; 15.6331 84.549; 86.322; 78.859 | 763.67 | Zeng, Xianghua; Gong, Chunhua; Zhang, Junyong; Xie, Jingli A simple and highly diasteroselective approach for the vicinal dichlorination of functional olefins RSC Adv., 2016, 6, 85182 |
| 7226497 | CIF | C15 H12 Cl2 O3 | P b c a | 7.1786; 20.0394; 20.1954 90; 90; 90 | 2905.2 | Zeng, Xianghua; Gong, Chunhua; Zhang, Junyong; Xie, Jingli A simple and highly diasteroselective approach for the vicinal dichlorination of functional olefins RSC Adv., 2016, 6, 85182 |
| 7226498 | CIF | C29 H48 Cl2 O2 | P 1 21 1 | 10.249; 7.6979; 19.7126 90; 95.778; 90 | 1547.34 | Zeng, Xianghua; Gong, Chunhua; Zhang, Junyong; Xie, Jingli A simple and highly diasteroselective approach for the vicinal dichlorination of functional olefins RSC Adv., 2016, 6, 85182 |
| 7226518 | CIF | C18 H14 B F2 N O S | P b c a | 10.661; 11.234; 25.712 90; 90; 90 | 3079.4 | Shanmugapriya, Jayabalan; Rajaguru, Kandasamy; Sivaraman, Gandhi; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai Boranil dye based “turn-on” fluorescent probes for detection of hydrogen peroxide and their cell imaging application RSC Adv., 2016, 6, 85838 |
| 7226519 | CIF | C23 H18 N4 O | C 1 2/c 1 | 21.2631; 14.0448; 16.208 90; 129.299; 90 | 3745.7 | Shanmugapriya, Jayabalan; Rajaguru, Kandasamy; Sivaraman, Gandhi; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai Boranil dye based “turn-on” fluorescent probes for detection of hydrogen peroxide and their cell imaging application RSC Adv., 2016, 6, 85838 |
| 7226520 | CIF | C83 H110 O20 | P 21 21 21 | 6.27813; 10.3446; 27.8319 90; 90; 90 | 1807.54 | Song, Jia-Ling; Yuan, Yao; Tan, Hai-Bo; Wu, Jie-Wei; Huang, Ri-Ming; Li, Heng; Xu, Zhi-Fang; Na, Ning; Qiu, Sheng-Xiang Euryachins A and B, a new type of diterpenoids from Eurya chinensis with potent NO production inhibitory activity RSC Adv., 2016, 6, 85958 |
| 7226545 | CIF | C50 H56 N2 Si2 | P -1 | 8.7368; 14.7568; 17.2163 83.552; 77.427; 76.645 | 2103.3 | Hoff, John J.; Zhu, Lei; Dong, Yutong; Albers, Thomas; Steel, Peter J.; Cui, Xianwei; Wen, Ying; Lebedyeva, Iryna; Miao, Shaobin Diazapentacene derivatives: synthesis, properties, and structures RSC Adv., 2016, 6, 86824 |
| 7226558 | CIF | C32 H24 Cl N3 O4 | P -1 | 9.914; 12.182; 12.358 99.856; 99.466; 107.794 | 1362.2 | Singh, Dharmender; Devi, Nisha; Kumar, Vipin; Malakar, Chandi C.; Mehra, Saloni; Rawal, Ravindra K.; Kaith, B. S.; Singh, Virender Metal-free 1,3-dipolar cycloaddition approach towards the regioselective synthesis of β-carboline and isoxazole based molecular hybrids RSC Adv., 2016, 6, 88066 |
| 7226579 | CIF | C50 H54 Ag2 N2 P2 S4 | P -1 | 10.538; 10.8294; 11.2159 78.167; 84.072; 77.604 | 1221.2 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226580 | CIF | C15 H26 N2 S4 | P -1 | 8.8763; 10.0172; 11.405 87.26; 74.873; 76.569 | 952.1 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226581 | CIF | C13 H17 Hg N S2 | P 1 21/n 1 | 8.799; 15.123; 11.633 90; 108.238; 90 | 1470.2 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226582 | CIF | C22 H37 Cl3 Co N3 S6 | P -1 | 10.2666; 12.0914; 14.7203 113.488; 94.486; 105.773 | 1576.39 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226583 | CIF | C14 H24 N2 S4 | P 1 21/c 1 | 12.7159; 6.4218; 22.3157 90; 104.133; 90 | 1767.1 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226584 | CIF | C14 H24 Cu N2 S4 | P 1 21/c 1 | 8.4525; 18.6204; 12.1412 90; 106.579; 90 | 1831.45 | Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L. Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties RSC Advances, 2016, 6, 93867-93880 |
| 7226612 | CIF | C16 H12 Cl N O2 S | C 1 c 1 | 23.6442; 4.2788; 14.2732 90; 90.614; 90 | 1443.92 | Parthiban, C.; Ciattini, Samuele; Chelazzi, Laura; Elango, Kuppanagounder P. Selective colorimetric sensing of fluoride in an aqueous solution by amino-naphthoquinone and its Co(ii), Ni(ii), Cu(ii) and Zn(ii) complexes ‒ effect of complex formation on sensing behaviour RSC Adv., 2016, 6, 91265 |
| 7226613 | CIF | C42.5 H114.3 K1.2 La N8.5 Na2 O110 P2 W22 | P 1 | 17.5783; 22.7463; 25.9258 102.255; 96.1105; 101.03 | 9825.3 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226614 | CIF | C41.5 H115.2 K1.3 N8.3 Na3.2 Nd O111.6 P2 W22 | P 1 | 12.826; 13.3186; 19.8495 103.758; 93.0038; 97.6501 | 3251.7 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226615 | CIF | C41.5 H122.2 K1.3 N8.3 Na3.2 O115.1 P2 Sm W22 | P 1 | 12.8341; 13.2819; 19.7712 103.714; 93.0424; 97.6039 | 3232.85 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226616 | CIF | C42.5 H120.3 Eu K1.2 N8 Na2 O113 P2 W22 | P 1 | 17.4826; 22.6885; 25.8377 102.26; 96.378; 100.699 | 9719.15 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226617 | CIF | C41.5 H133.2 Gd K1.3 N8.3 Na3.2 O120.6 P2 W22 | P 1 | 12.8744; 13.3048; 19.7946 103.687; 93.1594; 97.526 | 3252.9 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226618 | CIF | C41.5 H118.2 K1.3 N8.3 Na3.2 O113.1 P2 Tb W22 | P 1 | 12.8558; 13.2973; 19.7631 103.706; 92.9304; 97.5649 | 3241.77 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226619 | CIF | C41.5 H117.2 Dy K1.3 N8.3 Na3.2 O112.6 P2 W22 | P 1 | 12.8751; 13.3; 19.7296 103.88; 92.7303; 97.6425 | 3239.6 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226620 | CIF | C41.5 H109.2 Er K1.3 N8.3 Na3.2 O108.6 P2 W22 | P 1 | 12.841; 13.2876; 19.8313 103.579; 93.9442; 97.6353 | 3242.39 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
| 7226621 | CIF | C41.5 H119.2 K1.3 N8.3 Na3.2 O113.6 P2 Tm W22 | P 1 | 12.8257; 13.2693; 19.832 103.605; 93.8931; 97.6665 | 3233.83 | Iijima, Jun; Naruke, Haruo; Sanji, Takanobu On chirality induction in the crystalline solid-containing sandwich-type [Ln(α-PW11O39)2]11−polyoxotungstate and proline RSC Adv., 2016, 6, 91494 |
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