Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 18
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7226991 | CIF | C18 H14 N2 O4 S2 | P 1 21/c 1 | 13.7666; 4.7286; 25.9341 90; 97.914; 90 | 1672.15 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226992 | CIF | C19 H18 N2 O2 S2 | R 3 | 39.546; 39.546; 5.9306 90; 90; 120 | 8032.2 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226993 | CIF | C25 H27 Br N2 O4 S2 | P b c a | 10.1252; 14.6758; 34.2996 90; 90; 90 | 5096.8 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226994 | CIF | C19 H16 N2 O4 S2 | P c a 21 | 15.8547; 6.138; 37.0248 90; 90; 90 | 3603.1 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226995 | CIF | C40 H38 Br2 N4 O4 S4 | P 1 21/c 1 | 10.18976; 14.54422; 26.2201 90; 99.5359; 90 | 3832.18 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226996 | CIF | C26 H30 Br2 N2 O2 S2 | P 1 21/n 1 | 15.855; 5.37336; 16.575 90; 112.663; 90 | 1303.07 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7226997 | CIF | C24 H28 N2 O2 S2 | P 1 21 1 | 16.0248; 5.61472; 25.7171 90; 106.106; 90 | 2223.07 | Pop, Flavia; Lewis, William; Amabilino, David B. Solid state supramolecular structure of diketopyrrolopyrrole chromophores: correlating stacking geometry with visible light absorption CrystEngComm, 2016, 18, 8933 |
| 7227004 | CIF | C56 H36 Mg8 N4 Ni12 O89 P4 | C m c e | 28.0134; 17.8914; 12.7629 90; 90; 90 | 6396.8 | Geng, Yong-Jie; Zhang, Ai-Qin; Wu, Kun-Xian; Xue, Dong-Xu; Liu, Zhi-Hong A unique (3,10)-connected magnesium/nickel-based metal‒organic framework constructed from an unusual kgd supermolecular building layer via mixed linkers and solid solution approach CrystEngComm, 2016, 18, 8358 |
| 7227005 | CIF | C12 H16 Co K N8 | F m -3 m | 11.759; 11.759; 11.759 90; 90; 90 | 1625.96 | Qian, Kun; Shao, Feng; Yan, Zhihong; Pang, Jie; Chen, Xiaodong; Yang, Changxin A perovskite-type cage compound as a temperature-triggered dielectric switchable material CrystEngComm, 2016, 18, 7671 |
| 7227006 | CIF | C12 H16 Co K N8 | P m -3 m | 11.8233; 11.8233; 11.8233 90; 90; 90 | 1652.8 | Qian, Kun; Shao, Feng; Yan, Zhihong; Pang, Jie; Chen, Xiaodong; Yang, Changxin A perovskite-type cage compound as a temperature-triggered dielectric switchable material CrystEngComm, 2016, 18, 7671 |
| 7227007 | CIF | C12 H12 Br2 Cl N4 O2 | C 1 2/m 1 | 8.6301; 7.7579; 23.769 90; 98.599; 90 | 1573.5 | Nicolas, Irène; Jeannin, Olivier; Pichon, Delphine; Fourmigué, Marc Dibromohydantoins as halogen bond (XB) donors: a route toward the introduction of chirality in halogen bonded systems CrystEngComm, 2016, 18, 9325 |
| 7227008 | CIF | C7 H8 Br2 N3 O2 | P -1 | 7.714; 8.0925; 9.1626 64.045; 81.55; 85.532 | 508.65 | Nicolas, Irène; Jeannin, Olivier; Pichon, Delphine; Fourmigué, Marc Dibromohydantoins as halogen bond (XB) donors: a route toward the introduction of chirality in halogen bonded systems CrystEngComm, 2016, 18, 9325 |
| 7227009 | CIF | C12 H13 Br2 N3 O4 | P -1 | 6.1692; 7.97; 15.743 88.236; 81.458; 85.411 | 762.88 | Nicolas, Irène; Jeannin, Olivier; Pichon, Delphine; Fourmigué, Marc Dibromohydantoins as halogen bond (XB) donors: a route toward the introduction of chirality in halogen bonded systems CrystEngComm, 2016, 18, 9325 |
| 7227010 | CIF | C14 H17 Br2 N3 O4 | P 21 21 21 | 6.5779; 7.9462; 32.486 90; 90; 90 | 1698 | Nicolas, Irène; Jeannin, Olivier; Pichon, Delphine; Fourmigué, Marc Dibromohydantoins as halogen bond (XB) donors: a route toward the introduction of chirality in halogen bonded systems CrystEngComm, 2016, 18, 9325 |
| 7227011 | CIF | C11 H10 Br2 F3 N3 O2 | P 1 21/c 1 | 9.4108; 7.9826; 19.9558 90; 97.418; 90 | 1486.59 | Nicolas, Irène; Jeannin, Olivier; Pichon, Delphine; Fourmigué, Marc Dibromohydantoins as halogen bond (XB) donors: a route toward the introduction of chirality in halogen bonded systems CrystEngComm, 2016, 18, 9325 |
| 7227012 | CIF | C28 H26 Cu N4 O8 | P -1 | 9.2276; 11.6453; 12.8446 89.771; 76.772; 76.684 | 1305.78 | Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption CrystEngComm, 2016, 18, 9316 |
| 7227013 | CIF | C28 H32 Cu N4 O8 | P 1 21/c 1 | 9.0062; 19.4623; 16.0701 90; 94.442; 90 | 2808.3 | Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption CrystEngComm, 2016, 18, 9316 |
| 7227014 | CIF | C56 H58 N8 Ni2 O13 | P b c n | 18.447; 21.014; 28.775 90; 90; 90 | 11154.5 | Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption CrystEngComm, 2016, 18, 9316 |
| 7227015 | CIF | C36 H34 Cu3 N4 O12 | P -1 | 5.7315; 8.915; 18.554 76.76; 81.312; 82.111 | 907 | Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption CrystEngComm, 2016, 18, 9316 |
| 7227016 | CIF | C18 H18 Co N2 O6 | P 1 21/c 1 | 16.4579; 7.6329; 15.1328 90; 115.053; 90 | 1722.15 | Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption CrystEngComm, 2016, 18, 9316 |
| 7227029 | CIF | C24 H15 Br3 Cu3 O15 | C 1 2/m 1 | 14.042; 18.453; 17.33 90; 110.124; 90 | 4216 | Cheng, Fujun; Wang, Haijun; Hua, Yinying; Cao, Haifei; Zhou, Bihang; Duan, Jingui; Jin, Wanqin Halogen bonded supramolecular porous structures with a kgm layer CrystEngComm, 2016, 18, 9227 |
| 7227043 | CIF | C22 H14 N5 | P -1 | 7.5189; 8.8078; 13.135 87.752; 89.74; 80.065 | 856.16 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227044 | CIF | C22 H14 N5 | P 1 21/c 1 | 8.3571; 15.9841; 12.6113 90; 93.225; 90 | 1681.96 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227045 | CIF | C22 H10 F4 N5 | P 1 21/c 1 | 11.9675; 10.4959; 14.5659 90; 92.307; 90 | 1828.14 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227046 | CIF | C25 H21 F4 N6 O2 | P 1 21/n 1 | 7.1083; 25.3703; 12.9159 90; 100.474; 90 | 2290.44 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227047 | CIF | C25 H17 N6 O2 | P -1 | 7.088; 12.1413; 13.3964 110.968; 93.792; 103.933 | 1029.99 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227048 | CIF | C25 H25 N6 O2 | P -1 | 7.3694; 11.4503; 14.4977 66.999; 82.796; 88.216 | 1116.98 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227049 | CIF | C26 H23 N6 O3 | P -1 | 7.8219; 12.454; 13.5137 117.204; 90.126; 104.916 | 1120.3 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227050 | CIF | C24 H15 N6 O2 | P 1 21/a 1 | 7.3613; 37.7897; 7.9918 90; 115.71; 90 | 2003.08 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227051 | CIF | C26 H23 N6 | P 1 21/m 1 | 9.6649; 7.056; 16.1763 90; 96.103; 90 | 1096.9 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227052 | CIF | C40 H28 N12 | P -1 | 6.6808; 13.9762; 18.9142 96.805; 100.163; 95.734 | 1712.87 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227053 | CIF | C26 H19 F4 N6 | P -1 | 7.1455; 9.884; 16.27 82.795; 89.046; 82.02 | 1128.97 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227054 | CIF | C50 H30 N10 | P -1 | 7.7053; 10.2744; 12.1391 90.196; 97.753; 97.1 | 944.74 | Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M. Structural and optical investigations of charge transfer complexes involving the radical anions of TCNQ and F4TCNQ CrystEngComm, 2016, 18, 8906 |
| 7227055 | CIF | C96 H71.5 Co5 N25.5 O14.5 | P 1 21/n 1 | 13.555; 26.637; 28.386 90; 99.374; 90 | 10112.3 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227056 | CIF | C102 H87 Br4 Co5 N26 O11.5 | C 1 2/c 1 | 41.0956; 24.8982; 28.2361 90; 104.629; 90 | 27954.7 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227057 | CIF | C97 H73 Cl Co5 N24 O12 | P 1 21/n 1 | 13.241; 26.889; 28.423 90; 101.13; 90 | 9929 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227058 | CIF | C96 H72 Cl4 Fe2 N24 O9 Zn3 | P 1 21/c 1 | 12.9691; 26.539; 29.04 90; 104.905; 90 | 9658.9 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227059 | CIF | C37 H41 Br4 Cl Cu N10 O2 | P -1 | 10.9907; 14.3055; 18.0914 72.806; 87.022; 72.711 | 2592.6 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227060 | CIF | C57 H49 Cl Cu2 N18 O8 | P 4/n c c | 15.327; 15.327; 25.887 90; 90; 90 | 6081 | Feng, S. S.; Zheng, J. F.; Lu, L. P.; Lu, H. G.; Gao, Z. Q.; Dong, Y. H. Metal-responsive activation of C‒O and C‒C bonds of an aromatic vicinal diol in hydrothermal conditions: synthesis, structure, mechanism and magnetic properties CrystEngComm, 2016, 18, 9077 |
| 7227063 | CIF | C24 H18 N4 O9 | P -1 | 7.3884; 11.2382; 14.808 94.017; 96.891; 109.057 | 1145.92 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227064 | CIF | C17 H13 N3 O5 | P 1 21/c 1 | 14.4119; 7.3071; 15.2855 90; 106.646; 90 | 1542.25 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227065 | CIF | C17 H13 N3 O5 | P 1 21/c 1 | 6.5509; 9.5558; 24.5384 90; 91.662; 90 | 1535.44 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227066 | CIF | C17 H14 N2 O4 | P 1 21/c 1 | 9.0241; 11.982; 14.549 90; 107.874; 90 | 1497.2 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227067 | CIF | C18 H16 N2 O3 | P -1 | 3.9318; 11.7049; 16.914 99.084; 94.248; 94.176 | 763.7 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227068 | CIF | C17 H15 N2 O5.5 | C 1 2/c 1 | 16.7216; 10.9118; 18.807 90; 113.093; 90 | 3156.6 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227069 | CIF | C17 H16 N2 O6 | P 1 21/n 1 | 14.9671; 7.0737; 15.0978 90; 96.54; 90 | 1588.04 | Tarai, Arup; Baruah, Jubaraj B. Quaternary and senary sub-assemblies in cocrystals and salts of quinoline-4-carbaldoxime with aromatic carboxylic acids CrystEngComm, 2016, 18, 9095 |
| 7227070 | CIF | C49 H35 Br2 Cu F30 Gd N6 O14 | C 1 2/c 1 | 27.622; 10.446; 23.476 90; 107.661; 90 | 6454 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227071 | CIF | C49 H35 Br2 Cu Dy F30 N6 O14 | C 1 2/c 1 | 27.435; 10.4861; 23.51 90; 107.52; 90 | 6450 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227072 | CIF | C37 H22 Br Cu F30 Gd N3 O13 | P -1 | 11.73; 14.9975; 16.8333 82.081; 71.866; 79.621 | 2757.6 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227073 | CIF | C37 H22 Br Cu Dy F30 N3 O13 | P 1 21/n 1 | 17.578; 14.131; 22.056 90; 106.7; 90 | 5248 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227074 | CIF | C37 H22 Br Cu F30 La N3 O13 | P 1 21/c 1 | 14.835; 19.359; 18.279 90; 100.87; 90 | 5155.4 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227075 | CIF | C37 H22 Br Cu F30 N3 O13 Pr | P 1 21/c 1 | 14.802; 19.305; 18.193 90; 100.899; 90 | 5104.9 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu–Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227076 | CIF | C49 H35 Br2 Cu F30 N6 O14 Tb | C 1 2/c 1 | 27.231; 10.521; 23.519 90; 107.426; 90 | 6429 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227077 | CIF | C37 H22 Br Cu F30 N3 O13 Tb | P 1 21/n 1 | 17.6067; 14.1422; 22.0961 90; 106.795; 90 | 5267.2 | Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties CrystEngComm, 2016, 18, 9345 |
| 7227098 | CIF | C17 H11 Cl Co N2 O2 | P 42/n m c :2 | 17.5317; 17.5317; 15.757 90; 90; 90 | 4843.1 | Liu, Huiyan; Meng, Fei; Lu, Zhiyong; Bai, Junfeng A S4N4-like [Co4(μ-Cl)4] based metal‒organic framework with sum topology and selective CO2 uptake CrystEngComm, 2016, 18, 9003 |
| 7227099 | CIF | C24 H20 Mn N2 O8 | P 1 21/c 1 | 10.048; 20.458; 10.462 90; 92.797; 90 | 2148 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227100 | CIF | C12 H9 N O4 Zn | P 1 21/c 1 | 12.38; 6.836; 13.578 90; 114.624; 90 | 1044.6 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227101 | CIF | C12 H10 N2 O7 Pb | P 1 21/c 1 | 15.864; 10.2331; 8.453 90; 93.405; 90 | 1369.8 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227102 | CIF | C50 H54 Mn3 N4 O26 | P 1 21/c 1 | 13.412; 15.726; 12.078 90; 92.315; 90 | 2545.4 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227103 | CIF | C24 H20 N2 O8 Zn | C 1 2 1 | 21.133; 7.397; 15.679 90; 118.019; 90 | 2163.7 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227104 | CIF | C24 H16 N2 O6 Pb | P 1 21/c 1 | 20.213; 17.232; 7.666 90; 95.997; 90 | 2655.5 | Hu, Lei; Lin, Xiao-Ming; Lin, Jia; Zhang, Ru-Qiao; Zhang, Da-Liang; Cai, Yue-Peng Structural diversity of Mn(ii), Zn(ii) and Pb(ii) coordination polymers constructed from isomeric pyridylbenzoate N-oxide ligands: structures and electrochemical properties CrystEngComm, 2016, 18, 9307 |
| 7227123 | CIF | C5 H11 N O2 S | P 1 21/c 1 | 16.923; 4.7963; 9.884 90; 101.424; 90 | 786.4 | Smets, M. M. H.; Brugman, S. J. T.; van Eck, E. R. H.; Tinnemans, P.; Meekes, H.; Cuppen, H. M. Understanding the single-crystal-to-single-crystal solid-state phase transition of dl-methionine CrystEngComm, 2016, 18, 9363 |
| 7227124 | CIF | C5 H11 N O2 S | P 1 21/c 1 | 16.894; 4.7953; 9.8686 90; 101.318; 90 | 783.93 | Smets, M. M. H.; Brugman, S. J. T.; van Eck, E. R. H.; Tinnemans, P.; Meekes, H.; Cuppen, H. M. Understanding the single-crystal-to-single-crystal solid-state phase transition of dl-methionine CrystEngComm, 2016, 18, 9363 |
| 7227156 | CIF | C26 H33 Cl2 N5 O5 | P -1 | 9.785; 10.4737; 14.8053 80.999; 89.131; 70.023 | 1407.3 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227157 | CIF | C30 H39 Cl2 N5 O4 | P 1 21/c 1 | 14.6736; 14.8453; 15.2727 90; 114.517; 90 | 3027 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227158 | CIF | C26 H43 Cl2 N5 O10 | P -1 | 9.1549; 13.0427; 15.0857 69.094; 88.905; 77.835 | 1641.8 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227159 | CIF | C29 H41 Cl2 N5 O6 | P -1 | 10.3869; 10.6513; 14.8652 104.472; 97.659; 91.287 | 1575.54 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227160 | CIF | C26 H31 Cl2 N5 O4 | P b c a | 12.3231; 13.9721; 30.2678 90; 90; 90 | 5211.5 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227161 | CIF | C28 H41 Cl2 N5 O7 S | P -1 | 10.6335; 14.8355; 22.083 72.0962; 81.9476; 81.2892 | 3260.49 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227162 | CIF | C26 H41 Cl2 N5 O9 | P 1 21/n 1 | 12.3214; 12.7934; 20.7918 90; 102.051; 90 | 3205.24 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227163 | CIF | C30 H41 Cl2 N5 O7 | P -1 | 10.294; 11.1936; 14.8961 107.974; 98.064; 90.706 | 1613.7 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227164 | CIF | C27 H33 Cl2 N5 O4 | P 1 21/n 1 | 15.0423; 11.6835; 31.4491 90; 92.372; 90 | 5522.3 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227165 | CIF | C26 H29 Cl2 N5 O3 | P 1 21/a 1 | 24.1866; 8.1122; 13.0215 90; 91.868; 90 | 2553.55 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227166 | CIF | C26 H28 Cl2 N5 O4 | P -1 | 9.5877; 12.476; 12.9719 80.606; 77.792; 71.174 | 1427.84 | Tieger, Eszter; Kiss, Violetta; Pokol, György; Finta, Zoltán; Rohlíček, Jan; Skořepová, Eliška; Dušek, Michal Rationalization of the formation and stability of bosutinib solvated forms CrystEngComm, 2016, 18, 9260 |
| 7227167 | CIF | C28 H20 N2 O4 | C 1 2/c 1 | 23.385; 5.3635; 17.4866 90; 110.455; 90 | 2055 | Calvo-Castro, Jesus; Maczka, Sebastian; Thomson, Connor; Morris, Graeme; Kennedy, Alan R.; McHugh, Callum J. Twist and shout: a surprising synergy between aryl and N-substituents defines the computed charge transport properties in a series of crystalline diketopyrrolopyrroles CrystEngComm, 2016, 18, 9382 |
| 7227168 | CIF | C28 H20 N2 O2 S2 | P 1 21/n 1 | 5.5724; 11.3414; 17.3547 90; 96.822; 90 | 1089.03 | Calvo-Castro, Jesus; Maczka, Sebastian; Thomson, Connor; Morris, Graeme; Kennedy, Alan R.; McHugh, Callum J. Twist and shout: a surprising synergy between aryl and N-substituents defines the computed charge transport properties in a series of crystalline diketopyrrolopyrroles CrystEngComm, 2016, 18, 9382 |
| 7236160 | CIF | C18 H16 Cl2 Cu N4 | P b c a | 14.0408; 7.0121; 18.5908 90; 90; 90 | 1830.37 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236161 | CIF | C40 H46 Cu2 N10 O10 | P 1 21/n 1 | 12.4401; 11.2487; 15.3872 90; 93.715; 90 | 2148.68 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236162 | CIF | C36 H32 Cu N10 O6 | C 1 c 1 | 18.3728; 12.264; 15.3996 90; 96.439; 90 | 3448.01 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236163 | CIF | C38 H38 Cl2 Cu2 N8 O10 | P 1 21/n 1 | 7.8022; 22.6506; 11.4896 90; 92.226; 90 | 2028.96 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236164 | CIF | C36 H32 Cl2 Cu N8 O8 | A e a 2 | 17.4049; 17.5945; 11.9876 90; 90; 90 | 3671 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236165 | CIF | C38 H38 Cu2 F6 N8 O2 Si | P 1 21/n 1 | 11.2175; 27.351; 12.9381 90; 99.598; 90 | 3914 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236166 | CIF | C36 H32 Cu2 N8 O8 S2 | P 1 21/c 1 | 10.6138; 11.0181; 16.4294 90; 100.83; 90 | 1887.1 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236167 | CIF | C2 H6 N2 O | P 1 21/c 1 | 4.6147; 6.5781; 12.9004 90; 90.418; 90 | 391.59 | Baaklini, G.; Gbabode, G.; Clevers, S.; Négrier, P.; Mondieig, D.; Coquerel, G. Trimorphism of N-methylurea: crystal structures, phase transitions and thermodynamic stabilities CrystEngComm, 2016, 18, 4772 |
| 7236168 | CIF | C2 H6 N2 O | P 1 21/c 1 | 4.6604; 7.4079; 10.4566 90; 92.007; 90 | 360.78 | Baaklini, G.; Gbabode, G.; Clevers, S.; Négrier, P.; Mondieig, D.; Coquerel, G. Trimorphism of N-methylurea: crystal structures, phase transitions and thermodynamic stabilities CrystEngComm, 2016, 18, 4772 |
| 7236169 | CIF | C68 H56 Co7 N10 O39 | P -1 | 10.5995; 12.1967; 16.3411 98.732; 107.645; 109.102 | 1826.92 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236170 | CIF | C52 H50 N8 Ni5 O30 | C c c a :2 | 11.8454; 28.3935; 34.5364 90; 90; 90 | 11615.7 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236171 | CIF | C42 H24 N6 O19 Zn3 | P -1 | 9.6379; 10.2081; 12.1115 112.98; 99.703; 95.828 | 1062.79 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236172 | CIF | C45 H30 N6 O19 Zn3 | P -1 | 9.67809; 10.27573; 11.9152 112.179; 101.863; 93.0017 | 1062.75 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236173 | CIF | C36 H34 Cd3 N6 O21 | P -1 | 9.8669; 10.425; 12.4397 111.316; 102.568; 93.8625 | 1148.29 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236174 | CIF | C45 H30 Co3 N6 O19 | P -1 | 9.6701; 10.2782; 11.9406 112.322; 101.936; 92.9815 | 1062.89 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236175 | CIF | C42 H26 Mn3 N6 O20 | P -1 | 9.7826; 10.3101; 12.1333 112.088; 101.488; 94.1132 | 1096.65 | Xu, Yu-Ci; Chen, Yu; Qiu, Hai-Jiang; Zeng, Xiao-Shan; Xu, Hui-Ling; Li, Jie; Zeng, Yong-Fei; Xiao, Dong-Rong Metal nuclearity affects network connectivity: a series of highly connected metal‒organic frameworks based on polynuclear metal clusters as secondary building units CrystEngComm, 2016, 18, 8182 |
| 7236176 | CIF | C32 H21 Co N5 O6 | P 1 21/c 1 | 8.6354; 21.9273; 18.4048 90; 108.339; 90 | 3308 | Wang, Xiao-Xiao; Wang, Xiao-Qing; Niu, Xiao-Yan; Hu, Tuo-Ping Three novel metal‒organic frameworks based on an unsymmetrical rigid carboxylate ligand for luminescence sensing of nitrobenzene derivatives and magnetic properties CrystEngComm, 2016, 18, 7471 |
| 7236177 | CIF | C64 H42 Cd3 N10 O13 | A e a 2 | 31.98; 7.904; 26.8 90; 90; 90 | 6774 | Wang, Xiao-Xiao; Wang, Xiao-Qing; Niu, Xiao-Yan; Hu, Tuo-Ping Three novel metal‒organic frameworks based on an unsymmetrical rigid carboxylate ligand for luminescence sensing of nitrobenzene derivatives and magnetic properties CrystEngComm, 2016, 18, 7471 |
| 7236178 | CIF | C82 H58 Mn3 N14 O16 | P -1 | 9.856; 10.988; 17.309 80.255; 75.531; 86.663 | 1789 | Wang, Xiao-Xiao; Wang, Xiao-Qing; Niu, Xiao-Yan; Hu, Tuo-Ping Three novel metal‒organic frameworks based on an unsymmetrical rigid carboxylate ligand for luminescence sensing of nitrobenzene derivatives and magnetic properties CrystEngComm, 2016, 18, 7471 |
| 7236179 | CIF | C39 H35 Cd2 Cl5 Cr3 N7 O16 | C c c a :2 | 23.751; 30.607; 23.764 90; 90; 90 | 17275 | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block CrystEngComm, 2016, 18, 8578 |
| 7236180 | CIF | C36 H54 Cr3 Cu3 N13 O49 | P 63/m | 20.772; 20.772; 21.053 90; 90; 120 | 7867 | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block CrystEngComm, 2016, 18, 8578 |
| 7236181 | CIF | C46 H70 Cd2 Cr3 N11 O41 | P -4 21 c | 20.608; 20.608; 22.35 90; 90; 90 | 9491.8 | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block CrystEngComm, 2016, 18, 8578 |
| 7236182 | CIF | C117 H155 Cl14 Cr6 Cu6 N27 O42 | R -3 c :H | 21.6177; 21.6177; 61.464 90; 90; 120 | 24875.4 | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block CrystEngComm, 2016, 18, 8578 |
| 7236183 | CIF | C78 H84 Cl6 Cr6 Mn3 N14 O44 | P 63/m c m | 22.045; 22.045; 21.768 90; 90; 120 | 9161.6 | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block CrystEngComm, 2016, 18, 8578 |
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