Crystallography Open Database
Search results
Result : There are 170 entries in the selection
You can download the COD numbers of the selection as a text file
You can download all files as a single ZIP archive
Searching journal of publication like 'Physical chemistry chemical physics : PCCP' volume of publication is 20
| COD ID: 7228925 | |
| CIF file | Formula: - C13 H28 Cl4 Fe N O4 - Comments: Oba, Yukiko; Okuhata, Megumi; Osakai, Toshiyuki; Mochida, Tomoyuki Solvate and protic ionic liquids from aza-crown ethers: synthesis, thermal properties, and LCST behavior. Physical chemistry chemical physics : PCCP 20(5) (2018) 3118-3127 Space group: P -1 Cell volume: 1098.2 Cell parameters: 9.6258; 10.1155; 12.305; 109.255; 94.577; 100.77; |
| COD ID: 7229495 | |
| CIF file | Formula: - C46 H61 O3 P S - Comments: Hisamitsu, Shota; Yanai, Nobuhiro; Kouno, Hironori; Magome, Eisuke; Matsuki, Masaya; Yamada, Teppei; Monguzzi, Angelo; Kimizuka, Nobuo Two-dimensional structural ordering in a chromophoric ionic liquid for triplet energy migration-based photon upconversion. Physical chemistry chemical physics : PCCP 20(5) (2018) 3233-3240 Space group: P 1 21/c 1 Cell volume: 4112 Cell parameters: 23.205; 9.153; 19.653; 90; 99.912; 90; |
| COD ID: 7229515 | |
| CIF file | Formula: - C30 H18 N2 S3 - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P 1 c 1 Cell volume: 1162.43 Cell parameters: 12.36487; 9.88933; 9.81295; 90; 104.362; 90; |
| COD ID: 7229516 | |
| CIF file | Formula: - C41 H34 Cl3 N3 O4 S - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P -1 Cell volume: 1862.47 Cell parameters: 8.7193; 11.6007; 18.7861; 87.754; 87.804; 78.925; |
| COD ID: 7229517 | |
| CIF file | Formula: - C24 H26 N2 O3 S - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P 1 21/c 1 Cell volume: 1062.35 Cell parameters: 9.1049; 8.6592; 13.7163; 90; 100.773; 90; |
| COD ID: 7229518 | |
| CIF file | Formula: - C40 H33 N3 O S4 - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P 1 c 1 Cell volume: 3338.47 Cell parameters: 27.433; 14.3097; 8.5187; 90; 93.32; 90; |
| COD ID: 7229519 | |
| CIF file | Formula: - C24 H26 N2 O2 S2 - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P 1 21/c 1 Cell volume: 1072.88 Cell parameters: 8.7955; 9.477; 12.8838; 90; 92.537; 90; |
| COD ID: 7229520 | |
| CIF file | Formula: - C24 H26 N2 O4 - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P 1 21/n 1 Cell volume: 2011.51 Cell parameters: 13.41; 8.3348; 18.3351; 90; 101.022; 90; |
| COD ID: 7229521 | |
| CIF file | Formula: - C31 H19 Cl3 N2 O2 S - Comments: Pearce, Nicholas; Davies, E. Stephen; Horvath, Raphael; Pfeiffer, Constance R.; Sun, Xue-Zhong; Lewis, William; McMaster, Jonathan; George, Michael W.; Champness, Neil R. Thionated naphthalene diimides: tuneable chromophores for applications in photoactive dyads. Physical chemistry chemical physics : PCCP 20(2) (2018) 752-764 Space group: P b c a Cell volume: 5259.33 Cell parameters: 9.07634; 18.5416; 31.2516; 90; 90; 90; |
| COD ID: 7229592 | |
| CIF file | Formula: - C45 H38 S2 - Comments: Uematsu, K.; Noguchi, K.; Nakano, K. Synthesis and properties of [7]helicene and [7]helicene-like compounds with a cyclopenta[1,2-b:4,3-b']dithiophene or dithieno[2,3-b:3',2'-d]heterole skeleton. Physical chemistry chemical physics : PCCP 20(5) (2018) 3286-3295 Space group: C 1 2/c 1 Cell volume: 3415.84 Cell parameters: 22.8514; 12.0435; 13.7823; 90; 115.769; 90; |
| COD ID: 7229593 | |
| CIF file | Formula: - C30 H17 O P S2 - Comments: Uematsu, K.; Noguchi, K.; Nakano, K. Synthesis and properties of [7]helicene and [7]helicene-like compounds with a cyclopenta[1,2-b:4,3-b']dithiophene or dithieno[2,3-b:3',2'-d]heterole skeleton. Physical chemistry chemical physics : PCCP 20(5) (2018) 3286-3295 Space group: P 1 21/n 1 Cell volume: 2255.54 Cell parameters: 12.014; 9.11776; 21.2612; 90; 104.426; 90; |
| COD ID: 7229594 | |
| CIF file | Formula: - C26.5 H15.5 Cl1.5 N O S2 - Comments: Uematsu, K.; Noguchi, K.; Nakano, K. Synthesis and properties of [7]helicene and [7]helicene-like compounds with a cyclopenta[1,2-b:4,3-b']dithiophene or dithieno[2,3-b:3',2'-d]heterole skeleton. Physical chemistry chemical physics : PCCP 20(5) (2018) 3286-3295 Space group: P -1 Cell volume: 2102.73 Cell parameters: 12.1314; 12.3033; 14.3697; 83.5273; 85.5012; 81.3505; |
| COD ID: 7229615 | |
| CIF file | Formula: - C23 H19 N O3 Pt - Comments: Okamura, Naoki; Maeda, Takeshi; Fujiwara, Hideki; Soman, Anjaly; Unni, K. N. Narayanan; Ajayaghosh, Ayyappanpillai; Yagi, Shigeyuki Photokinetic study on remarkable excimer phosphorescence from heteroleptic cyclometalated platinum(ii) complexes bearing a benzoylated 2-phenylpyridinate ligand. Physical chemistry chemical physics : PCCP 20(1) (2017) 542-552 Space group: P 1 21/c 1 Cell volume: 1945.6 Cell parameters: 14.133; 8.6154; 16.031; 90; 94.639; 90; |
| COD ID: 7229616 | |
| CIF file | Formula: - C23 H18 F N O3 Pt - Comments: Okamura, Naoki; Maeda, Takeshi; Fujiwara, Hideki; Soman, Anjaly; Unni, K. N. Narayanan; Ajayaghosh, Ayyappanpillai; Yagi, Shigeyuki Photokinetic study on remarkable excimer phosphorescence from heteroleptic cyclometalated platinum(ii) complexes bearing a benzoylated 2-phenylpyridinate ligand. Physical chemistry chemical physics : PCCP 20(1) (2017) 542-552 Space group: P -1 Cell volume: 962 Cell parameters: 6.9367; 11.512; 13.017; 81.915; 76.395; 72.742; |
| COD ID: 7229617 | |
| CIF file | Formula: - C23 H17 F2 N O3 Pt - Comments: Okamura, Naoki; Maeda, Takeshi; Fujiwara, Hideki; Soman, Anjaly; Unni, K. N. Narayanan; Ajayaghosh, Ayyappanpillai; Yagi, Shigeyuki Photokinetic study on remarkable excimer phosphorescence from heteroleptic cyclometalated platinum(ii) complexes bearing a benzoylated 2-phenylpyridinate ligand. Physical chemistry chemical physics : PCCP 20(1) (2017) 542-552 Space group: P 1 21/c 1 Cell volume: 2002.9 Cell parameters: 11.922; 12.312; 14.055; 90; 103.866; 90; |
| COD ID: 7229631 | |
| CIF file | Formula: - C19 H12 N4 - Comments: Reig, Marta; Puigdollers, Joaquim; Velasco, Dolores Solid-state organization of n-type carbazole-based semiconductors for organic thin-film transistors. Physical chemistry chemical physics : PCCP 20(2) (2018) 1142-1149 Space group: P 1 21/c 1 Cell volume: 1456.18 Cell parameters: 7.0914; 12.8955; 16.1234; 90; 99.027; 90; |
| COD ID: 7229632 | |
| CIF file | Formula: - C25 H24 N4 - Comments: Reig, Marta; Puigdollers, Joaquim; Velasco, Dolores Solid-state organization of n-type carbazole-based semiconductors for organic thin-film transistors. Physical chemistry chemical physics : PCCP 20(2) (2018) 1142-1149 Space group: P -1 Cell volume: 1087.5 Cell parameters: 7.917; 8.777; 16.892; 92.79; 102.2; 107.3; |
| COD ID: 7229633 | |
| CIF file | Formula: - C21 H16 N4 - Comments: Reig, Marta; Puigdollers, Joaquim; Velasco, Dolores Solid-state organization of n-type carbazole-based semiconductors for organic thin-film transistors. Physical chemistry chemical physics : PCCP 20(2) (2018) 1142-1149 Space group: P 1 21/c 1 Cell volume: 1632.2 Cell parameters: 8.7842; 24.486; 8.1096; 90; 110.652; 90; |
| COD ID: 7229634 | |
| CIF file | Formula: - C29 H32 N4 - Comments: Reig, Marta; Puigdollers, Joaquim; Velasco, Dolores Solid-state organization of n-type carbazole-based semiconductors for organic thin-film transistors. Physical chemistry chemical physics : PCCP 20(2) (2018) 1142-1149 Space group: P -1 Cell volume: 1289.4 Cell parameters: 7.7023; 8.911; 20.022; 77.669; 84.775; 73.953; |
| COD ID: 7229648 | |
| CIF file | Formula: - C6 H10 O4 - Comments: Mir, Sajjad Husain; Takasaki, Yuichi; Takamizawa, Satoshi An organoferroelasticity driven by molecular conformational change. Physical chemistry chemical physics : PCCP 20(7) (2018) 4631-4635 Space group: P 1 21/c 1 Cell volume: 356.34 Cell parameters: 7.3663; 5.1555; 10.1436; 90; 112.329; 90; |
| COD ID: 7229649 | |
| CIF file | Formula: - C6 H10 O4 - Comments: Mir, Sajjad Husain; Takasaki, Yuichi; Takamizawa, Satoshi An organoferroelasticity driven by molecular conformational change. Physical chemistry chemical physics : PCCP 20(7) (2018) 4631-4635 Space group: P 1 21/c 1 Cell volume: 356.56 Cell parameters: 7.3693; 5.1566; 10.1453; 90; 112.354; 90; |
| COD ID: 7229694 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2451.5 Cell parameters: 9.126; 10.606; 25.328; 90; 90; 90; |
| COD ID: 7229695 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2468.6 Cell parameters: 9.147; 10.64; 25.365; 90; 90; 90; |
| COD ID: 7229696 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2477.5 Cell parameters: 9.158; 10.658; 25.383; 90; 90; 90; |
| COD ID: 7229697 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2443.5 Cell parameters: 9.116; 10.59; 25.311; 90; 90; 90; |
| COD ID: 7229698 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2515.6 Cell parameters: 9.203; 10.737; 25.458; 90; 90; 90; |
| COD ID: 7229699 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2436.2 Cell parameters: 9.107; 10.575; 25.296; 90; 90; 90; |
| COD ID: 7229700 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2459.6 Cell parameters: 9.136; 10.622; 25.346; 90; 90; 90; |
| COD ID: 7229701 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2495.9 Cell parameters: 9.179; 10.697; 25.42; 90; 90; 90; |
| COD ID: 7229702 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2486.5 Cell parameters: 9.168; 10.677; 25.402; 90; 90; 90; |
| COD ID: 7229703 | |
| CIF file | Formula: - C7 H5 N O - Comments: Mohanraj, J.; Capria, E.; Benevoli, L.; Perucchi, A.; Demitri, N.; Fraleoni-Morgera, A XRD- and infrared-probed anisotropic thermal expansion properties of an organic semiconducting single crystal. Physical chemistry chemical physics : PCCP 20(3) (2018) 1984-1992 Space group: P b c n Cell volume: 2505.6 Cell parameters: 9.191; 10.716; 25.44; 90; 90; 90; |
| COD ID: 7229705 | |
| CIF file | Formula: - C48 H44 N2 O4 - Comments: Fuentes Pineda, Rosinda; Troughton, Joel; Planells, Miquel; Sanchez-Molina Santos, Irene; Muhith, Farmin; Nichol, Gary S.; Haque, Saif; Watson, Trystan; Robertson, Neil Effect of alkyl chain length on the properties of triphenylamine-based hole transport materials and their performance in perovskite solar cells. Physical chemistry chemical physics : PCCP 20(2) (2018) 1252-1260 Space group: P 1 21/n 1 Cell volume: 1920.41 Cell parameters: 9.8398; 18.2197; 10.8932; 90; 100.468; 90; |
| COD ID: 7229706 | |
| CIF file | Formula: - C52 H52 N2 O4 - Comments: Fuentes Pineda, Rosinda; Troughton, Joel; Planells, Miquel; Sanchez-Molina Santos, Irene; Muhith, Farmin; Nichol, Gary S.; Haque, Saif; Watson, Trystan; Robertson, Neil Effect of alkyl chain length on the properties of triphenylamine-based hole transport materials and their performance in perovskite solar cells. Physical chemistry chemical physics : PCCP 20(2) (2018) 1252-1260 Space group: P 1 21/n 1 Cell volume: 2080.18 Cell parameters: 12.051; 10.2594; 17.3214; 90; 103.75; 90; |
| COD ID: 7229707 | |
| CIF file | Formula: - C56 H60 N2 O4 - Comments: Fuentes Pineda, Rosinda; Troughton, Joel; Planells, Miquel; Sanchez-Molina Santos, Irene; Muhith, Farmin; Nichol, Gary S.; Haque, Saif; Watson, Trystan; Robertson, Neil Effect of alkyl chain length on the properties of triphenylamine-based hole transport materials and their performance in perovskite solar cells. Physical chemistry chemical physics : PCCP 20(2) (2018) 1252-1260 Space group: P 1 21/c 1 Cell volume: 2319.16 Cell parameters: 11.82431; 13.11889; 14.97854; 90; 93.5009; 90; |
| COD ID: 7229708 | |
| CIF file | Formula: - C52 H52 N2 O4 - Comments: Fuentes Pineda, Rosinda; Troughton, Joel; Planells, Miquel; Sanchez-Molina Santos, Irene; Muhith, Farmin; Nichol, Gary S.; Haque, Saif; Watson, Trystan; Robertson, Neil Effect of alkyl chain length on the properties of triphenylamine-based hole transport materials and their performance in perovskite solar cells. Physical chemistry chemical physics : PCCP 20(2) (2018) 1252-1260 Space group: P -1 Cell volume: 4425.55 Cell parameters: 12.4603; 14.8711; 24.3863; 100.569; 90.6323; 94.7035; |
| COD ID: 7229754 | |
| CIF file | Formula: - C34 H29 N3 O3 - Comments: Bhattacharjee, Indranil; Ghosh, Nita; Raina, Abhinav; Dasgupta, Jyotishman; Ray, Debdas Conformational switching via an intramolecular H-bond modulates the fluorescence lifetime in a novel coumarin-imidazole conjugate. Physical chemistry chemical physics : PCCP 20(9) (2018) 6060-6072 Space group: P 1 21/n 1 Cell volume: 2762.32 Cell parameters: 14.0571; 13.268; 15.3305; 90; 104.964; 90; |
| COD ID: 7229755 | |
| CIF file | Formula: - C34 H29 N3 O2 - Comments: Bhattacharjee, Indranil; Ghosh, Nita; Raina, Abhinav; Dasgupta, Jyotishman; Ray, Debdas Conformational switching via an intramolecular H-bond modulates the fluorescence lifetime in a novel coumarin-imidazole conjugate. Physical chemistry chemical physics : PCCP 20(9) (2018) 6060-6072 Space group: P -1 Cell volume: 1364.18 Cell parameters: 9.8322; 11.6973; 12.975; 113.245; 93.22; 93.119; |
| COD ID: 7229765 | |
| CIF file | Formula: - C34 H24 Eu N9 O9 - Comments: Polzin, P.; V Eliani, I; Ströh, J; Braun, M.; Ruser, N.; Heidenreich, N.; Rönfeldt, P; Bertram, F.; Näther, C; Wöhlbrandt, S; Suta, M.; Terraschke, H. From ligand exchange to reaction intermediates: what does really happen during the synthesis of emissive complexes? Physical chemistry chemical physics : PCCP 20(11) (2018) 7428-7437 Space group: C 1 2/c 1 Cell volume: 3312.48 Cell parameters: 12.5871; 15.7676; 17.0644; 90; 102.021; 90; |
| COD ID: 7229847 | |
| CIF file | Formula: - C32 H32 N2 O4 S4 - Comments: Cappuccino, C.; Mazzeo, P. P.; Salzillo, T.; Venuti, E.; Giunchi, A.; Della Valle, R. G.; Brillante, A.; Bettini, C.; Melucci, M.; Maini, L. A synergic approach of X-ray powder diffraction and Raman spectroscopy for crystal structure determination of 2,3-thienoimide capped oligothiophenes. Physical chemistry chemical physics : PCCP 20(5) (2018) 3630-3636 Space group: P -1 Cell volume: 797.3 Cell parameters: 4.914; 5.655; 28.95; 87.035; 84.31; 85.513; |
| COD ID: 7229848 | |
| CIF file | Formula: - C36 H40 N2 O4 S4 - Comments: Cappuccino, C.; Mazzeo, P. P.; Salzillo, T.; Venuti, E.; Giunchi, A.; Della Valle, R. G.; Brillante, A.; Bettini, C.; Melucci, M.; Maini, L. A synergic approach of X-ray powder diffraction and Raman spectroscopy for crystal structure determination of 2,3-thienoimide capped oligothiophenes. Physical chemistry chemical physics : PCCP 20(5) (2018) 3630-3636 Space group: P -1 Cell volume: 875.6 Cell parameters: 5.406; 5.135; 32.36; 101.877; 91.55; 94.423; |
| COD ID: 7229891 | |
| CIF file | Formula: - C40 H24 - Comments: Singh, Anuja; Pati, Avik Kumar; Mishra, Ashok Kumar Photophysics and peripheral ring size dependent aggregate emission of cross-conjugated enediynes: applications to white light emission and vapor sensing. Physical chemistry chemical physics : PCCP 20(6) (2018) 4167-4180 Space group: P 1 21/n 1 Cell volume: 2731.7 Cell parameters: 12.6331; 15.3655; 14.1392; 90; 95.557; 90; |
| COD ID: 7229949 | |
| CIF file | Formula: - C11 H9 N3 O - Comments: Böhnke, Hendrik; Bahrenburg, Julia; Ma, Xiaonan; Röttger, Katharina; Näther, Christian; Rode, Michał F; Sobolewski, Andrzej L.; Temps, Friedrich Ultrafast dynamics of the ESIPT photoswitch N-(3-pyridinyl)-2-pyridinecarboxamide. Physical chemistry chemical physics : PCCP 20(4) (2018) 2646-2655 Space group: P 1 21/n 1 Cell volume: 952.37 Cell parameters: 5.7147; 8.3019; 20.1261; 90; 94.12; 90; |
| COD ID: 7230005 | |
| CIF file | Formula: - Co4 H52 K10 O94 V2 W18 - Comments: Liu, Boyang; Glass, Elliot N.; Wang, Ru-Pan; Cui, Yi-Tao; Harada, Yoshihisa; Huang, Di-Jing; Schuppler, Stefan; Hill, Craig L.; de Groot, Frank M. F. Cobalt-to-vanadium charge transfer in polyoxometalate water oxidation catalysts revealed by 2p3d resonant inelastic X-ray scattering. Physical chemistry chemical physics : PCCP 20(6) (2018) 4554-4562 Space group: P 1 21/n 1 Cell volume: 4113.46 Cell parameters: 12.3089; 21.3544; 15.6623; 90; 92.315; 90; |
| COD ID: 7230006 | |
| CIF file | Formula: - Co4 H20 Na10 O108 P2 W18 - Comments: Liu, Boyang; Glass, Elliot N.; Wang, Ru-Pan; Cui, Yi-Tao; Harada, Yoshihisa; Huang, Di-Jing; Schuppler, Stefan; Hill, Craig L.; de Groot, Frank M. F. Cobalt-to-vanadium charge transfer in polyoxometalate water oxidation catalysts revealed by 2p3d resonant inelastic X-ray scattering. Physical chemistry chemical physics : PCCP 20(6) (2018) 4554-4562 Space group: P -1 Cell volume: 2461.78 Cell parameters: 11.4798; 13.277; 18.2209; 71.135; 73.672; 73.251; |
| COD ID: 7230040 | |
| CIF file | Formula: - C7 H4 N2 O2 Se - Comments: Wang, Hui; Liu, Ju; Wang, Weizhou Intermolecular and very strong intramolecular C-SeO/N chalcogen bonds in nitrophenyl selenocyanate crystals. Physical chemistry chemical physics : PCCP 20(7) (2018) 5227-5234 Space group: P 1 21/c 1 Cell volume: 806.6 Cell parameters: 7.9873; 7.9532; 12.6983; 90; 90.639; 90; |
| COD ID: 7230041 | |
| CIF file | Formula: - C7 H4 N2 O2 Se - Comments: Wang, Hui; Liu, Ju; Wang, Weizhou Intermolecular and very strong intramolecular C-SeO/N chalcogen bonds in nitrophenyl selenocyanate crystals. Physical chemistry chemical physics : PCCP 20(7) (2018) 5227-5234 Space group: P 1 21 1 Cell volume: 400.29 Cell parameters: 3.9678; 6.9334; 14.5948; 90; 94.469; 90; |
| COD ID: 7230042 | |
| CIF file | Formula: - C7 H4 N2 O2 Se - Comments: Wang, Hui; Liu, Ju; Wang, Weizhou Intermolecular and very strong intramolecular C-SeO/N chalcogen bonds in nitrophenyl selenocyanate crystals. Physical chemistry chemical physics : PCCP 20(7) (2018) 5227-5234 Space group: P 1 21 1 Cell volume: 400.17 Cell parameters: 3.9951; 6.9821; 14.3544; 90; 91.94; 90; |
| COD ID: 7230076 | |
| CIF file | Formula: - C8 H8 - Comments: Ward, Matthew D.; Huang, Haw-Tyng; Zhu, Li; Biswas, Arani; Popov, Dmitry; Badding, John V.; Strobel, Timothy A. Chemistry through cocrystals: pressure-induced polymerization of C<sub>2</sub>H<sub>2</sub>·C<sub>6</sub>H<sub>6</sub> to an extended crystalline hydrocarbon. Physical chemistry chemical physics : PCCP 20(10) (2018) 7282-7294 Space group: R -3 m :H Cell volume: 468.37 Cell parameters: 8.1945; 8.1945; 8.0541; 90; 90; 120; |
| COD ID: 7230130 | |
| CIF file | Formula: - C26 H21 B F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: C 1 2/c 1 Cell volume: 1975.94 Cell parameters: 13.246; 12.7829; 12.8418; 90; 114.67; 90; |
| COD ID: 7230131 | |
| CIF file | Formula: - C26 H20 B Cl3 F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P 1 2/c 1 Cell volume: 2476.9 Cell parameters: 14.2315; 11.3053; 15.4276; 90; 93.737; 90; |
| COD ID: 7230132 | |
| CIF file | Formula: - C63 H58 B2 F4 N4 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P -1 Cell volume: 1222.2 Cell parameters: 8.568; 9.7581; 15.2034; 101.961; 91.811; 99.856; |
| COD ID: 7230133 | |
| CIF file | Formula: - C37 H27 B F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P -1 Cell volume: 2779.4 Cell parameters: 10.3605; 13.301; 21.611; 76.897; 82.836; 73.801; |
| COD ID: 7230134 | |
| CIF file | Formula: - C24 H17 B F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P 1 21/n 1 Cell volume: 3718.1 Cell parameters: 14.2177; 13.2738; 19.7784; 90; 95.067; 90; |
| COD ID: 7230135 | |
| CIF file | Formula: - C31 H23 B F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P -1 Cell volume: 1392.9 Cell parameters: 8.9484; 9.6443; 17.849; 87.62; 77.07; 68.24; |
| COD ID: 7230136 | |
| CIF file | Formula: - C32 H33 B F2 N2 - Comments: Filatov, Mikhail A.; Karuthedath, Safakath; Polestshuk, Pavel M.; Callaghan, Susan; Flanagan, Keith J.; Telitchko, Maxime; Wiesner, Thomas; Laquai, Frédéric; Senge, Mathias O. Control of triplet state generation in heavy atom-free BODIPY-anthracene dyads by media polarity and structural factors. Physical chemistry chemical physics : PCCP 20(12) (2018) 8016-8031 Space group: P 1 21/c 1 Cell volume: 2480.7 Cell parameters: 15.836; 20.573; 7.781; 90; 101.878; 90; |
| COD ID: 7230191 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 432.23 Cell parameters: 4.0055; 10.6493; 10.2948; 90; 100.172; 90; |
| COD ID: 7230192 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 435.9 Cell parameters: 4.0549; 11.078; 9.8719; 90; 100.585; 90; |
| COD ID: 7230193 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 433.81 Cell parameters: 4.0172; 10.6917; 10.2615; 90; 100.175; 90; |
| COD ID: 7230194 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 438.06 Cell parameters: 4.0686; 11.1298; 9.8431; 90; 100.64; 90; |
| COD ID: 7230195 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 434.47 Cell parameters: 4.0233; 10.7193; 10.2355; 90; 100.184; 90; |
| COD ID: 7230196 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 436.79 Cell parameters: 4.0618; 11.1039; 9.8533; 90; 100.618; 90; |
| COD ID: 7230197 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 438.5 Cell parameters: 4.0723; 11.1474; 9.8296; 90; 100.671; 90; |
| COD ID: 7230198 | |
| CIF file | Formula: - C6 H2 Br4 - Comments: Zakharov, Boris A.; Michalchuk, Adam A. L.; Morrison, Carole A.; Boldyreva, Elena V. Anisotropic lattice softening near the structural phase transition in the thermosalient crystal 1,2,4,5-tetrabromobenzene. Physical chemistry chemical physics : PCCP 20(13) (2018) 8523-8532 Space group: P 1 21/n 1 Cell volume: 432.96 Cell parameters: 4.0108; 10.6672; 10.2811; 90; 100.168; 90; |
| COD ID: 7230343 | |
| CIF file | Formula: - C23 H13 Br O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P 1 21/c 1 Cell volume: 1615.48 Cell parameters: 9.7948; 21.5595; 7.9044; 90; 104.573; 90; |
| COD ID: 7230344 | |
| CIF file | Formula: - C23 H13 I O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P 1 21/c 1 Cell volume: 1676.83 Cell parameters: 9.8713; 21.9189; 8.0295; 90; 105.165; 90; |
| COD ID: 7230345 | |
| CIF file | Formula: - C23 H13 Br O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P -1 Cell volume: 783.98 Cell parameters: 7.905; 9.5802; 10.62; 94.977; 101.008; 93.532; |
| COD ID: 7230346 | |
| CIF file | Formula: - C23 H9 F5 O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P 21 21 21 Cell volume: 1609 Cell parameters: 7.9511; 8.4125; 24.0545; 90; 90; 90; |
| COD ID: 7230347 | |
| CIF file | Formula: - C29 H18 O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P 21 21 21 Cell volume: 1859.2 Cell parameters: 5.2858; 8.206; 42.862; 90; 90; 90; |
| COD ID: 7230348 | |
| CIF file | Formula: - C23 H14 O - Comments: Zhang, Yingying; He, Bairong; Liu, Junkai; Hu, Shimin; Pan, Lingxiang; Zhao, Zujin; Tang, Ben Zhong Aggregation-induced emission and the working mechanism of 1-benzoyl and 1-benzyl pyrene derivatives. Physical chemistry chemical physics : PCCP 20(15) (2018) 9922-9929 Space group: P -1 Cell volume: 765.36 Cell parameters: 8.6959; 8.9304; 11.2041; 69.755; 80.944; 69.789; |
| COD ID: 7230381 | |
| CIF file | Formula: - C26 H24 Cl Fe2 N4 Ni0.5 - Comments: Peck, M. A.; Hearne, G. R.; Obuah, C.; Darkwa, J. Electron-density distributions in selected ferrocenyl-pyrazolyl late transition-metal complexes. Physical chemistry chemical physics : PCCP 20(17) (2018) 11682-11691 Space group: C 1 2/c 1 Cell volume: 4594.6 Cell parameters: 23.97; 10.6828; 19.264; 90; 111.342; 90; |
| COD ID: 7230391 | |
| CIF file | Formula: - C40 H35 Cl4 N4 O3 - Comments: Giannoulis, A.; Ackermann, K.; Spindler, P. E.; Higgins, C.; Cordes, D. B.; Slawin, A. M. Z.; Prisner, T. F.; Bode, B. E. Nitroxide-nitroxide and nitroxide-metal distance measurements in transition metal complexes with two or three paramagnetic centres give access to thermodynamic and kinetic stabilities. Physical chemistry chemical physics : PCCP 20(16) (2018) 11196-11205 Space group: I 1 2/a 1 Cell volume: 7461 Cell parameters: 16.901; 9.2057; 47.963; 90; 91.149; 90; |
| COD ID: 7230392 | |
| CIF file | Formula: - C15 H17 I N O3 - Comments: Giannoulis, A.; Ackermann, K.; Spindler, P. E.; Higgins, C.; Cordes, D. B.; Slawin, A. M. Z.; Prisner, T. F.; Bode, B. E. Nitroxide-nitroxide and nitroxide-metal distance measurements in transition metal complexes with two or three paramagnetic centres give access to thermodynamic and kinetic stabilities. Physical chemistry chemical physics : PCCP 20(16) (2018) 11196-11205 Space group: P -1 Cell volume: 786.4 Cell parameters: 9.0407; 9.359; 10.191; 105.821; 94.648; 105.915; |
| COD ID: 7230466 | |
| CIF file | Formula: - C125 H53 Dy N5 Ni Sc2 - Comments: Krylov, D. S.; Liu, F.; Brandenburg, A.; Spree, L.; Bon, V.; Kaskel, S.; Wolter, A. U. B.; Büchner, B; Avdoshenko, S. M.; Popov, A. A. Magnetization relaxation in the single-ion magnet DySc<sub>2</sub>N@C<sub>80</sub>: quantum tunneling, magnetic dilution, and unconventional temperature dependence. Physical chemistry chemical physics : PCCP 20(17) (2018) 11656-11672 Space group: C 1 2/c 1 Cell volume: 14903 Cell parameters: 25.19; 15.05; 39.49; 90; 95.46; 90; |
| COD ID: 7230467 | |
| CIF file | Formula: - C129.29 H58.28 Dy N5 Ni Sc2 - Comments: Krylov, D. S.; Liu, F.; Brandenburg, A.; Spree, L.; Bon, V.; Kaskel, S.; Wolter, A. U. B.; Büchner, B; Avdoshenko, S. M.; Popov, A. A. Magnetization relaxation in the single-ion magnet DySc<sub>2</sub>N@C<sub>80</sub>: quantum tunneling, magnetic dilution, and unconventional temperature dependence. Physical chemistry chemical physics : PCCP 20(17) (2018) 11656-11672 Space group: P -1 Cell volume: 3750.6 Cell parameters: 14.57; 14.68; 20.28; 83.73; 84.16; 60.6; |
| COD ID: 7230483 | |
| CIF file | Formula: - C36 H32 N2 - Comments: Wright, Iain A.; Al-Attar, Hameed A; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R. Conformationally-restricted bicarbazoles with phenylene bridges displaying deep-blue emission and high triplet energies: systematic structure-property relationships. Physical chemistry chemical physics : PCCP 20(17) (2018) 11867-11875 Space group: P b c n Cell volume: 2621.32 Cell parameters: 38.7879; 8.0972; 8.3462; 90; 90; 90; |
| COD ID: 7230484 | |
| CIF file | Formula: - C36 H26 N4 - Comments: Wright, Iain A.; Al-Attar, Hameed A; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R. Conformationally-restricted bicarbazoles with phenylene bridges displaying deep-blue emission and high triplet energies: systematic structure-property relationships. Physical chemistry chemical physics : PCCP 20(17) (2018) 11867-11875 Space group: P -1 Cell volume: 1312.62 Cell parameters: 9.3712; 12.2475; 12.7385; 92.853; 102.427; 111.744; |
| COD ID: 7230569 | |
| CIF file | Formula: - C24 H53 Br3 Cu N2 O2 - Comments: Zhiltsova, Elena P.; Pashirova, Tatiana N.; Ibatullina, Marina R.; Lukashenko, Svetlana S.; Gubaidullin, Aidar T.; Islamov, Daut R.; Kataeva, Olga N.; Kutyreva, Marianna P.; Zakharova, Lucia Y. A new surfactant-copper(ii) complex based on 1,4-diazabicyclo[2.2.2]octane amphiphile. Crystal structure determination, self-assembly and functional activity. Physical chemistry chemical physics : PCCP 20(18) (2018) 12688-12699 Space group: P 1 21/n 1 Cell volume: 3100.7 Cell parameters: 7.5437; 44.0092; 9.3422; 90; 91.326; 90; |
| COD ID: 7230583 | |
| CIF file | Formula: - C31 H29 N - Comments: Liu, Xuedan; Li, Aisen; Xu, Weiqing; Ma, Zhiyong; Jia, Xinru Pressure-induced emission band separation of the hybridized local and charge transfer excited state in a TPE-based crystal. Physical chemistry chemical physics : PCCP 20(19) (2018) 13249-13254 Space group: P 21 21 21 Cell volume: 2376.9 Cell parameters: 9.5324; 14.9752; 16.6507; 90; 90; 90; |
| COD ID: 7230596 | |
| CIF file | Formula: - C18 H20 Cl N3 O7 S - Comments: Surov, Artem O.; Churakov, Andrei V.; Proshin, Alexey N.; Dai, Xia-Lin; Lu, Tongbu; Perlovich, German L. Cocrystals of a 1,2,4-thiadiazole-based potent neuroprotector with gallic acid: solubility, thermodynamic stability relationships and formation pathways. Physical chemistry chemical physics : PCCP 20(21) (2018) 14469-14481 Space group: P -1 Cell volume: 1021.97 Cell parameters: 9.6276; 10.1883; 11.0539; 90.533; 100.803; 105.94; |
| COD ID: 7230632 | |
| CIF file | Formula: - C19 H24 N2 O2 - Comments: Orita, Ryoji; Franckevičius, Marius; Vyšniauskas, Aurimas; Gulbinas, Vidmantas; Sugiyama, Haruki; Uekusa, Hidehiro; Kanosue, Kenta; Ishige, Ryohei; Ando, Shinji Enhanced fluorescence of phthalimide compounds induced by the incorporation of electron-donating alicyclic amino groups. Physical chemistry chemical physics : PCCP 20(23) (2018) 16033-16044 Space group: P 1 21/n 1 Cell volume: 1685.11 Cell parameters: 6.7785; 9.8025; 25.4462; 90; 94.7017; 90; |
| COD ID: 7230633 | |
| CIF file | Formula: - C18 H22 N2 O2 - Comments: Orita, Ryoji; Franckevičius, Marius; Vyšniauskas, Aurimas; Gulbinas, Vidmantas; Sugiyama, Haruki; Uekusa, Hidehiro; Kanosue, Kenta; Ishige, Ryohei; Ando, Shinji Enhanced fluorescence of phthalimide compounds induced by the incorporation of electron-donating alicyclic amino groups. Physical chemistry chemical physics : PCCP 20(23) (2018) 16033-16044 Space group: P 1 21/c 1 Cell volume: 1541.11 Cell parameters: 5.1353; 10.3387; 29.0552; 90; 92.523; 90; |
| COD ID: 7230634 | |
| CIF file | Formula: - C19 H24 N2 O2 - Comments: Orita, Ryoji; Franckevičius, Marius; Vyšniauskas, Aurimas; Gulbinas, Vidmantas; Sugiyama, Haruki; Uekusa, Hidehiro; Kanosue, Kenta; Ishige, Ryohei; Ando, Shinji Enhanced fluorescence of phthalimide compounds induced by the incorporation of electron-donating alicyclic amino groups. Physical chemistry chemical physics : PCCP 20(23) (2018) 16033-16044 Space group: P -1 Cell volume: 811.18 Cell parameters: 5.26649; 10.6373; 15.2944; 72.6185; 89.9112; 83.0728; |
| COD ID: 7230635 | |
| CIF file | Formula: - C18 H22 N2 O2 - Comments: Orita, Ryoji; Franckevičius, Marius; Vyšniauskas, Aurimas; Gulbinas, Vidmantas; Sugiyama, Haruki; Uekusa, Hidehiro; Kanosue, Kenta; Ishige, Ryohei; Ando, Shinji Enhanced fluorescence of phthalimide compounds induced by the incorporation of electron-donating alicyclic amino groups. Physical chemistry chemical physics : PCCP 20(23) (2018) 16033-16044 Space group: P 1 21/c 1 Cell volume: 3063.4 Cell parameters: 10.7455; 26.6113; 10.8489; 90; 99.08; 90; |
| COD ID: 7230818 | |
| CIF file | Formula: - C14 H13 F N2 O S - Comments: Hughes, Eleri; Griffin, John M.; Coogan, Michael P.; Middleton, David A. Average orientation of a fluoroaromatic molecule in lipid bilayers from DFT-informed NMR measurements of <sup>1</sup>H-<sup>19</sup>F dipolar couplings. Physical chemistry chemical physics : PCCP 20(27) (2018) 18207-18215 Space group: P b c a Cell volume: 2566.33 Cell parameters: 9.54533; 14.9685; 17.9615; 90; 90; 90; |
| COD ID: 7230848 | |
| CIF file | Formula: - C42 H51 N3 - Comments: Reig, Marta; Bagdziunas, Gintautas; Ramanavicius, Arunas; Puigdollers, Joaquim; Velasco, Dolores Interface engineering and solid-state organization for triindole-based p-type organic thin-film transistors. Physical chemistry chemical physics : PCCP 20(26) (2018) 17889-17898 Space group: P -1 Cell volume: 3348 Cell parameters: 8.411; 15.202; 26.348; 86.9; 89.438; 84.427; |
| COD ID: 7230888 | |
| CIF file | Formula: - C36 H43 Cu3 N7 O8 - Comments: Mathivathanan, Logesh; Boudalis, Athanassios K.; Turek, Philippe; Pissas, Michael; Sanakis, Yiannis; Raptis, Raphael G. Interactions between H-bonded [Cu(μ<sub>3</sub>-OH)] triangles; a combined magnetic susceptibility and EPR study. Physical chemistry chemical physics : PCCP 20(25) (2018) 17234-17244 Space group: P -1 Cell volume: 1948.6 Cell parameters: 11.417; 12.317; 15.889; 73.446; 79.252; 65.891; |
| COD ID: 7230907 | |
| CIF file | Formula: - C23 H14 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P -1 Cell volume: 753.4 Cell parameters: 8.0024; 9.6519; 10.0837; 102.814; 96.576; 91.473; |
| COD ID: 7230908 | |
| CIF file | Formula: - C21 H14 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P 1 21 1 Cell volume: 727.18 Cell parameters: 8.3434; 6.0678; 14.7523; 90; 103.178; 90; |
| COD ID: 7230909 | |
| CIF file | Formula: - C17 H12 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P 21 21 21 Cell volume: 1225.2 Cell parameters: 6.215; 12.803; 15.398; 90; 90; 90; |
| COD ID: 7230910 | |
| CIF file | Formula: - C29 H18 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P 1 21/c 1 Cell volume: 1913.6 Cell parameters: 6.635; 15.315; 19.049; 90; 98.654; 90; |
| COD ID: 7230911 | |
| CIF file | Formula: - C25 H16 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P c a 21 Cell volume: 1713.3 Cell parameters: 25.998; 8.5054; 7.748; 90; 90; 90; |
| COD ID: 7230912 | |
| CIF file | Formula: - C21 H14 O - Comments: Rajagopal, Shinaj K.; K, Nagaraj; Deb, Somadrita; Bhat, Vinayak; Sasikumar, Devika; Sebastian, Ebin; Hariharan, Mahesh Extending the scope of the carbonyl facilitated triplet excited state towards visible light excitation. Physical chemistry chemical physics : PCCP 20(28) (2018) 19120-19128 Space group: P 1 21/n 1 Cell volume: 1493.8 Cell parameters: 14.081; 7.291; 15.214; 90; 106.982; 90; |
| COD ID: 7231074 | |
| CIF file | Formula: - C128 H168 N15 O17 P S - Comments: Marques, Igor; Costa, Pedro M. R.; Q Miranda, Margarida; Busschaert, Nathalie; Howe, Ethan N. W.; Clarke, Harriet J.; Haynes, Cally J. E.; Kirby, Isabelle L.; Rodilla, Ananda M.; Pérez-Tomás, Ricardo; Gale, Philip A.; Félix, Vítor Full elucidation of the transmembrane anion transport mechanism of squaramides using in silico investigations. Physical chemistry chemical physics : PCCP 20(32) (2018) 20796-20811 Space group: C 1 2/c 1 Cell volume: 25375.3 Cell parameters: 28.4389; 15.9129; 56.0834; 90; 91.1396; 90; |
| COD ID: 7231075 | |
| CIF file | Formula: - C30 H30 N4 O6 S2 - Comments: Marques, Igor; Costa, Pedro M. R.; Q Miranda, Margarida; Busschaert, Nathalie; Howe, Ethan N. W.; Clarke, Harriet J.; Haynes, Cally J. E.; Kirby, Isabelle L.; Rodilla, Ananda M.; Pérez-Tomás, Ricardo; Gale, Philip A.; Félix, Vítor Full elucidation of the transmembrane anion transport mechanism of squaramides using in silico investigations. Physical chemistry chemical physics : PCCP 20(32) (2018) 20796-20811 Space group: P -1 Cell volume: 1483.5 Cell parameters: 9.638; 10.144; 15.997; 102.159; 95.626; 101.283; |
| COD ID: 7231076 | |
| CIF file | Formula: - C39 H24 Cl2 F16 Ir N6 P - Comments: Soulsby, Lachlan C.; Hayne, David J.; Doeven, Egan H.; Wilson, David J. D.; Agugiaro, Johnny; Connell, Timothy U.; Chen, Lifen; Hogan, Conor F.; Kerr, Emily; Adcock, Jacqui L.; Donnelly, Paul S.; White, Jonathan M.; Francis, Paul S. Mixed annihilation electrogenerated chemiluminescence of iridium(iii) complexes. Physical chemistry chemical physics : PCCP 20(28) (2018) 18995-19006 Space group: P -1 Cell volume: 2077.79 Cell parameters: 11.9028; 12.4757; 14.8516; 84.354; 77.044; 75.399; |
| COD ID: 7231317 | |
| CIF file | Formula: - C13 H29 Br I3 N - Comments: Watson, Brandon; Grounds, Olivia; Borley, William; Rosokha, Sergiy V. Resolving the halogen vs. hydrogen bonding dichotomy in solutions: intermolecular complexes of trihalomethanes with halide and pseudohalide anions. Physical chemistry chemical physics : PCCP 20(34) (2018) 21999-22007 Space group: P 1 n 1 Cell volume: 1030.62 Cell parameters: 8.7748; 8.9163; 13.3043; 90; 98.065; 90; |
| COD ID: 7231318 | |
| CIF file | Formula: - C13 H29 Cl I3 N - Comments: Watson, Brandon; Grounds, Olivia; Borley, William; Rosokha, Sergiy V. Resolving the halogen vs. hydrogen bonding dichotomy in solutions: intermolecular complexes of trihalomethanes with halide and pseudohalide anions. Physical chemistry chemical physics : PCCP 20(34) (2018) 21999-22007 Space group: P 1 n 1 Cell volume: 1005.39 Cell parameters: 8.7174; 8.8068; 13.2169; 90; 97.763; 90; |
| COD ID: 7231319 | |
| CIF file | Formula: - C17 H37 I4 N - Comments: Watson, Brandon; Grounds, Olivia; Borley, William; Rosokha, Sergiy V. Resolving the halogen vs. hydrogen bonding dichotomy in solutions: intermolecular complexes of trihalomethanes with halide and pseudohalide anions. Physical chemistry chemical physics : PCCP 20(34) (2018) 21999-22007 Space group: P b c a Cell volume: 4985 Cell parameters: 15.9191; 17.5775; 17.8152; 90; 90; 90; |
| COD ID: 7231349 | |
| CIF file | Formula: - C14 H12 N2 O2 - Comments: Dixit, Manish Kumar; Dubey, Mrigendra Li<sup>+</sup>-Induced fluorescent metallogel: a case of ESIPT-CHEF and ICT phenomenon. Physical chemistry chemical physics : PCCP 20(36) (2018) 23762-23772 Space group: P 1 21/n 1 Cell volume: 604.8 Cell parameters: 8.5166; 6.3092; 11.828; 90; 107.898; 90; |
| COD ID: 7231350 | |
| CIF file | Formula: - C9 H5 I N2 O2 - Comments: Vinueza, Nelson R.; Jankiewicz, Bartłomiej J; Gallardo, Vanessa A.; Nash, John J.; Kenttämaa, Hilkka I Effects of hydrogen bonding on the gas-phase reactivity of didehydroisoquinolinium cation isomers. Physical chemistry chemical physics : PCCP 20(33) (2018) 21567-21572 Space group: P -1 Cell volume: 456.6 Cell parameters: 7.6101; 8.0298; 8.5371; 81.12; 65.955; 73.612; |
| COD ID: 7231364 | |
| CIF file | Formula: - C6 H14 Cr N2 Na O12 - Comments: Ptak, Maciej; Stefańska, Dagmara; Gągor, Anna; Svane, Katrine L.; Walsh, Aron; Paraguassu, Waldeci Heterometallic perovskite-type metal-organic framework with an ammonium cation: structure, phonons, and optical response of [NH<sub>4</sub>]Na<sub>0.5</sub>Cr<sub>x</sub>Al<sub>0.5-x</sub>(HCOO)<sub>3</sub> (x = 0, 0.025 and 0.5). Physical chemistry chemical physics : PCCP 20(34) (2018) 22284-22295 Space group: R -3 :H Cell volume: 1173.1 Cell parameters: 7.9386; 7.9386; 21.494; 90; 90; 120; |
| COD ID: 7231402 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 399.19 Cell parameters: 7.3678; 7.3678; 8.4912; 90; 90; 120; |
| COD ID: 7231403 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 395.131 Cell parameters: 7.32804; 7.32804; 8.4964; 90; 90; 120; |
| COD ID: 7231404 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 395.52 Cell parameters: 7.33778; 7.33778; 8.4822; 90; 90; 120; |
| COD ID: 7231405 | |
| CIF file | Formula: - C6 H14 Mn2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 670.6 Cell parameters: 6.714; 7.119; 14.031; 90; 89.99; 90; |
| COD ID: 7231406 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 374.6 Cell parameters: 6.64; 8.4889; 7.422; 90; 116.45; 90; |
| COD ID: 7231407 | |
| CIF file | Formula: - C6 H14 Mn2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 661.1 Cell parameters: 6.68; 7.097; 13.944; 90; 89.98; 90; |
| COD ID: 7231408 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 363.8 Cell parameters: 6.443; 8.496; 7.372; 90; 115.64; 90; |
| COD ID: 7231409 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 339.26 Cell parameters: 6.47; 8.0553; 7.263; 90; 116.33; 90; |
| COD ID: 7231410 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 344.9 Cell parameters: 6.607; 8.0559; 7.27; 90; 116.96; 90; |
| COD ID: 7231411 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 336.9 Cell parameters: 6.426; 8.0477; 7.255; 90; 116.12; 90; |
| COD ID: 7231412 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 368.9 Cell parameters: 6.537; 8.4865; 7.405; 90; 116.09; 90; |
| COD ID: 7231413 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 385.619 Cell parameters: 7.3163; 7.3163; 8.31849; 90; 90; 120; |
| COD ID: 7231414 | |
| CIF file | Formula: - C6 H14 Mn2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 650.5 Cell parameters: 6.651; 7.067; 13.839; 90; 89.96; 90; |
| COD ID: 7231415 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 359.757 Cell parameters: 7.1831; 7.1831; 8.0511; 90; 90; 120; |
| COD ID: 7231416 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 386.58 Cell parameters: 7.3249; 7.3249; 8.3197; 90; 90; 120; |
| COD ID: 7231417 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 354.64 Cell parameters: 7.1272; 7.1272; 8.0615; 90; 90; 120; |
| COD ID: 7231418 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 366.179 Cell parameters: 7.24917; 7.24917; 8.04612; 90; 90; 120; |
| COD ID: 7231419 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 383.062 Cell parameters: 7.28439; 7.28439; 8.3359; 90; 90; 120; |
| COD ID: 7231420 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 363.48 Cell parameters: 7.2211; 7.2211; 8.049; 90; 90; 120; |
| COD ID: 7231421 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 384.358 Cell parameters: 7.3044; 7.3044; 8.31833; 90; 90; 120; |
| COD ID: 7231422 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 372.14 Cell parameters: 6.8121; 8.3238; 7.3916; 90; 117.39; 90; |
| COD ID: 7231423 | |
| CIF file | Formula: - C6 H14 Fe2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 635.5 Cell parameters: 6.589; 7.004; 13.771; 90; 90; 90; |
| COD ID: 7231424 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 369.619 Cell parameters: 7.2789; 7.2789; 8.0555; 90; 90; 120; |
| COD ID: 7231425 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 379.6 Cell parameters: 6.741; 8.486; 7.44; 90; 116.87; 90; |
| COD ID: 7231426 | |
| CIF file | Formula: - C3 H7 Fe N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 383.337 Cell parameters: 7.29055; 7.29055; 8.32778; 90; 90; 120; |
| COD ID: 7231427 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 357 Cell parameters: 7.15551; 7.15551; 8.05112; 90; 90; 120; |
| COD ID: 7231428 | |
| CIF file | Formula: - C6 H14 Fe2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 628.7 Cell parameters: 6.599; 6.957; 13.695; 90; 90.19; 90; |
| COD ID: 7231429 | |
| CIF file | Formula: - C6 H14 Fe2 N2 O12 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 628.6 Cell parameters: 6.558; 6.9977; 13.697; 90; 90.05; 90; |
| COD ID: 7231430 | |
| CIF file | Formula: - C3 H7 Mn N O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 391.31 Cell parameters: 7.2974; 7.2974; 8.485; 90; 90; 120; |
| COD ID: 7231431 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 63 2 2 Cell volume: 369.776 Cell parameters: 7.28362; 7.28362; 8.04848; 90; 90; 120; |
| COD ID: 7231432 | |
| CIF file | Formula: - C3 H7 N Ni O6 - Comments: Collings, Ines E.; Manna, Rudra Sekhar; Tsirlin, Alexander A.; Bykov, Maxim; Bykova, Elena; Hanfland, Michael; Gegenwart, Philipp; van Smaalen, Sander; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Pressure dependence of spin canting in ammonium metal formate antiferromagnets. Physical chemistry chemical physics : PCCP 20(37) (2018) 24465-24476 Space group: P 1 21 1 Cell volume: 334.1 Cell parameters: 6.373; 8.036; 7.247; 90; 115.83; 90; |
| COD ID: 7231447 | |
| CIF file | Formula: - C19 H19 N4 O Si - Comments: Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Studer, Armido; Eckert, Hellmut; Neugebauer, Johannes Ferro- or antiferromagnetism? Heisenberg chains in the crystal structures of verdazyl radicals. Physical chemistry chemical physics : PCCP 20(35) (2018) 22902-22908 Space group: C 1 m 1 Cell volume: 931.9 Cell parameters: 9.6565; 17.991; 5.8635; 90; 113.819; 90; |
| COD ID: 7231448 | |
| CIF file | Formula: - C16 H11 N4 O - Comments: Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Studer, Armido; Eckert, Hellmut; Neugebauer, Johannes Ferro- or antiferromagnetism? Heisenberg chains in the crystal structures of verdazyl radicals. Physical chemistry chemical physics : PCCP 20(35) (2018) 22902-22908 Space group: P n a 21 Cell volume: 1349.68 Cell parameters: 17.0182; 20.5047; 3.8678; 90; 90; 90; |
| COD ID: 7231449 | |
| CIF file | Formula: - C18 H11 N4 O - Comments: Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Studer, Armido; Eckert, Hellmut; Neugebauer, Johannes Ferro- or antiferromagnetism? Heisenberg chains in the crystal structures of verdazyl radicals. Physical chemistry chemical physics : PCCP 20(35) (2018) 22902-22908 Space group: C 1 m 1 Cell volume: 713.42 Cell parameters: 11.27; 16.9544; 3.7589; 90; 96.64; 90; |
| COD ID: 7231450 | |
| CIF file | Formula: - C21 H19 N4 O Si - Comments: Eusterwiemann, Steffen; Doerenkamp, Carsten; Dresselhaus, Thomas; Janka, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Studer, Armido; Eckert, Hellmut; Neugebauer, Johannes Ferro- or antiferromagnetism? Heisenberg chains in the crystal structures of verdazyl radicals. Physical chemistry chemical physics : PCCP 20(35) (2018) 22902-22908 Space group: P 1 21/m 1 Cell volume: 999.8 Cell parameters: 5.9346; 16.9487; 10.0933; 90; 99.999; 90; |
| COD ID: 7231451 | |
| CIF file | Formula: - C30 H32 N4 O3 - Comments: Wu, Jieyun; Wang, Wen; Wang, Nan; He, Juan; Deng, Guowei; Li, Zhonghui; Zhang, Xiaoling; Xiao, Hongyan; Chen, Kaixin Structure-property analysis of julolidine-based nonlinear optical chromophores for the optimization of microscopic and macroscopic nonlinearity. Physical chemistry chemical physics : PCCP 20(36) (2018) 23606-23615 Space group: P -1 Cell volume: 2706.6 Cell parameters: 11.085; 12.074; 20.89; 93.358; 90.469; 104.074; |
| COD ID: 7231471 | |
| CIF file | Formula: - C6 H4 N2 O4 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 1 21/n 1 Cell volume: 331.831 Cell parameters: 5.6628; 5.3723; 10.9143; 90; 92.021; 90; |
| COD ID: 7231472 | |
| CIF file | Formula: - C5 H7 B Cl N O2 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 1 c 1 Cell volume: 351.359 Cell parameters: 6.2062; 5.25334; 11.18373; 90; 105.503; 90; |
| COD ID: 7231473 | |
| CIF file | Formula: - C14 H14 N2 O8 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 21 21 21 Cell volume: 1410.48 Cell parameters: 4.544; 15.2652; 20.3342; 90; 90; 90; |
| COD ID: 7231474 | |
| CIF file | Formula: - C5 H7 B Cl N O2 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 1 c 1 Cell volume: 351.359 Cell parameters: 6.2062; 5.25334; 11.18373; 90; 105.503; 90; |
| COD ID: 7231475 | |
| CIF file | Formula: - C6 H4 N2 O4 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 1 21/n 1 Cell volume: 331.991 Cell parameters: 5.66357; 5.37326; 10.91612; 90; 92.0201; 90; |
| COD ID: 7231476 | |
| CIF file | Formula: - C14 H14 N2 O8 - Comments: Escudero-Adán, Eduardo C; Bauzá, Antonio; Lecomte, Claude; Frontera, Antonio; Ballester, Pablo Boron triel bonding: a weak electrostatic interaction lacking electron-density descriptors. Physical chemistry chemical physics : PCCP 20(37) (2018) 24192-24200 Space group: P 21 21 21 Cell volume: 1409.47 Cell parameters: 4.54306; 15.2647; 20.3244; 90; 90; 90; |
| COD ID: 7231482 | |
| CIF file | Formula: - C32 H28 N4 O2 S2 - Comments: Dutta, Basudeb; Datta, Joydeep; Maity, Suvendu; Sinha, Chittaranjan; Sun, Di; Ray, Partha Pratim; Mir, Mohammad Hedayetullah Electrical property and Schottky behavior of a flexible Schiff-base compound: X-ray structure and stabilization of 1D water chain. Physical chemistry chemical physics : PCCP 20(38) (2018) 24744-24749 Space group: P -1 Cell volume: 718.02 Cell parameters: 5.4376; 8.0683; 17.0332; 77.328; 84.635; 80.612; |
| COD ID: 7231483 | |
| CIF file | Formula: - C34 H26 - Comments: Yu, Binhong; Liu, Danyang; Wang, Yi; Zhang, Ting; Zhang, Yu-Mo; Li, Minjie; Zhang, Sean Xiao-An Strong and insusceptible photo-emissions from an intramolecular weak hydrogen bond strengthened twisted fluorophore. Physical chemistry chemical physics : PCCP 20(37) (2018) 23851-23855 Space group: P -1 Cell volume: 1229.6 Cell parameters: 9.1613; 11.267; 13.686; 103; 108.72; 103.56; |
| COD ID: 7231484 | |
| CIF file | Formula: - C36 H32 O3 - Comments: Yu, Binhong; Liu, Danyang; Wang, Yi; Zhang, Ting; Zhang, Yu-Mo; Li, Minjie; Zhang, Sean Xiao-An Strong and insusceptible photo-emissions from an intramolecular weak hydrogen bond strengthened twisted fluorophore. Physical chemistry chemical physics : PCCP 20(37) (2018) 23851-23855 Space group: P b c a Cell volume: 5470.4 Cell parameters: 18.1516; 10.532; 28.615; 90; 90; 90; |
| COD ID: 7231485 | |
| CIF file | Formula: - C36 H30 O2 - Comments: Yu, Binhong; Liu, Danyang; Wang, Yi; Zhang, Ting; Zhang, Yu-Mo; Li, Minjie; Zhang, Sean Xiao-An Strong and insusceptible photo-emissions from an intramolecular weak hydrogen bond strengthened twisted fluorophore. Physical chemistry chemical physics : PCCP 20(37) (2018) 23851-23855 Space group: P 1 21/c 1 Cell volume: 1349.6 Cell parameters: 15.885; 7.3696; 12.251; 90; 109.78; 90; |
| COD ID: 7231486 | |
| CIF file | Formula: - C36 H30 - Comments: Yu, Binhong; Liu, Danyang; Wang, Yi; Zhang, Ting; Zhang, Yu-Mo; Li, Minjie; Zhang, Sean Xiao-An Strong and insusceptible photo-emissions from an intramolecular weak hydrogen bond strengthened twisted fluorophore. Physical chemistry chemical physics : PCCP 20(37) (2018) 23851-23855 Space group: P 1 21/n 1 Cell volume: 1324.16 Cell parameters: 9.024; 8.3079; 17.6624; 90; 90.015; 90; |
| COD ID: 7231487 | |
| CIF file | Formula: - C34 H20 O2 - Comments: Yu, Binhong; Liu, Danyang; Wang, Yi; Zhang, Ting; Zhang, Yu-Mo; Li, Minjie; Zhang, Sean Xiao-An Strong and insusceptible photo-emissions from an intramolecular weak hydrogen bond strengthened twisted fluorophore. Physical chemistry chemical physics : PCCP 20(37) (2018) 23851-23855 Space group: C 1 2/c 1 Cell volume: 2283.1 Cell parameters: 28.335; 5.014; 19.7; 90; 125.34; 90; |
| COD ID: 7231519 | |
| CIF file | Formula: - C63 H51 Cu F6 N7 O P3 - Comments: Zhang, Ying; Traber, Philipp; Zedler, Linda; Kupfer, Stephan; Gräfe, Stefanie; Schulz, Martin; Frey, Wolfgang; Karnahl, Michael; Dietzek, Benjamin Cu(i) vs. Ru(ii) photosensitizers: elucidation of electron transfer processes within a series of structurally related complexes containing an extended π-system. Physical chemistry chemical physics : PCCP 20(38) (2018) 24843-24857 Space group: P 1 21/n 1 Cell volume: 5626 Cell parameters: 11.44; 28.561; 18.045; 90; 107.39; 90; |
| COD ID: 7231520 | |
| CIF file | Formula: - C63.25 H55.5 Cl0.5 Cu F6 N4 O1.5 P3 - Comments: Zhang, Ying; Traber, Philipp; Zedler, Linda; Kupfer, Stephan; Gräfe, Stefanie; Schulz, Martin; Frey, Wolfgang; Karnahl, Michael; Dietzek, Benjamin Cu(i) vs. Ru(ii) photosensitizers: elucidation of electron transfer processes within a series of structurally related complexes containing an extended π-system. Physical chemistry chemical physics : PCCP 20(38) (2018) 24843-24857 Space group: P -1 Cell volume: 5963.9 Cell parameters: 12.3503; 21.56; 23.198; 102.835; 94.635; 95.324; |
| COD ID: 7231531 | |
| CIF file | Formula: - C38 H34 N4 - Comments: Nikolaou, Vasilis; Plass, Fabian; Planchat, Aurélien; Charisiadis, Asterios; Charalambidis, Georgios; Angaridis, Panagiotis A.; Kahnt, Axel; Odobel, Fabrice; Coutsolelos, Athanassios G. Effect of the triazole ring in zinc porphyrin-fullerene dyads on the charge transfer processes in NiO-based devices. Physical chemistry chemical physics : PCCP 20(37) (2018) 24477-24489 Space group: P 1 21/c 1 Cell volume: 1518.8 Cell parameters: 13.658; 13.839; 8.1732; 90; 100.54; 90; |
| COD ID: 7231584 | |
| CIF file | Formula: - Li4 O4 Si - Comments: Grasso, M. L.; Blanco, M. V.; Cova, F.; González, J A; Arneodo Larochette, P.; Gennari, F. C. Evaluation of the formation and carbon dioxide capture by Li<sub>4</sub>SiO<sub>4</sub> using in situ synchrotron powder X-ray diffraction studies. Physical chemistry chemical physics : PCCP 20(41) (2018) 26570-26579 Space group: P 1 21/m 1 Cell volume: 1162.8 Cell parameters: 11.5518; 6.0963; 16.7209; 90; 99.075; 90; |
| COD ID: 7231668 | |
| CIF file | Formula: - C51 H36 N4 - Comments: Kundu, Anu; Karthikeyan, Subramanian; Sagara, Yoshimitsu; Moon, Dohyun; Anthony, Savarimuthu Philip Unusual fluorescent photoswitching of imidazole derivatives: the role of molecular conformation and twist angle controlled organic solid state fluorescence. Physical chemistry chemical physics : PCCP 20(43) (2018) 27385-27393 Space group: P 1 21/c 1 Cell volume: 3700.6 Cell parameters: 14.552; 14.684; 17.328; 90; 91.92; 90; |
| COD ID: 7231669 | |
| CIF file | Formula: - C40 H33 N3 O - Comments: Kundu, Anu; Karthikeyan, Subramanian; Sagara, Yoshimitsu; Moon, Dohyun; Anthony, Savarimuthu Philip Unusual fluorescent photoswitching of imidazole derivatives: the role of molecular conformation and twist angle controlled organic solid state fluorescence. Physical chemistry chemical physics : PCCP 20(43) (2018) 27385-27393 Space group: P 1 21/c 1 Cell volume: 3060.1 Cell parameters: 10.602; 16.393; 18.032; 90; 102.46; 90; |
| COD ID: 7231670 | |
| CIF file | Formula: - C39 H29 N3 - Comments: Kundu, Anu; Karthikeyan, Subramanian; Sagara, Yoshimitsu; Moon, Dohyun; Anthony, Savarimuthu Philip Unusual fluorescent photoswitching of imidazole derivatives: the role of molecular conformation and twist angle controlled organic solid state fluorescence. Physical chemistry chemical physics : PCCP 20(43) (2018) 27385-27393 Space group: C 1 2/c 1 Cell volume: 5821 Cell parameters: 17.931; 12.546; 27.155; 90; 107.66; 90; |
| COD ID: 7231671 | |
| CIF file | Formula: - C39 H29 N3 - Comments: Kundu, Anu; Karthikeyan, Subramanian; Sagara, Yoshimitsu; Moon, Dohyun; Anthony, Savarimuthu Philip Unusual fluorescent photoswitching of imidazole derivatives: the role of molecular conformation and twist angle controlled organic solid state fluorescence. Physical chemistry chemical physics : PCCP 20(43) (2018) 27385-27393 Space group: P -1 Cell volume: 1432.6 Cell parameters: 9.467; 10.183; 15.829; 84.16; 76.29; 75.31; |
| COD ID: 7231672 | |
| CIF file | Formula: - C39 H27 N3 - Comments: Kundu, Anu; Karthikeyan, Subramanian; Sagara, Yoshimitsu; Moon, Dohyun; Anthony, Savarimuthu Philip Unusual fluorescent photoswitching of imidazole derivatives: the role of molecular conformation and twist angle controlled organic solid state fluorescence. Physical chemistry chemical physics : PCCP 20(43) (2018) 27385-27393 Space group: P 1 21/c 1 Cell volume: 2752.9 Cell parameters: 17.587; 7.74; 21.032; 90; 105.94; 90; |
| COD ID: 7231780 | |
| CIF file | Formula: - C50.5 H104 F1.5 I1.5 N4 O3.49 S0.5 - Comments: Exner, Jessica; Eusterwiemann, Steffen; Janka, Oliver; Doerenkamp, Carsten; Massolle, Anja; Niehaus, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Neugebauer, Johannes; Studer, Armido; Eckert, Hellmut Antiferromagnetic ordering based on intermolecular London dispersion interactions in amphiphilic TEMPO ammonium salts. Physical chemistry chemical physics : PCCP 20(46) (2018) 28979-28983 Space group: P 1 21/c 1 Cell volume: 5735.8 Cell parameters: 25.112; 18.588; 12.3475; 90; 95.627; 90; |
| COD ID: 7231781 | |
| CIF file | Formula: - C26 H54 I N2 O - Comments: Exner, Jessica; Eusterwiemann, Steffen; Janka, Oliver; Doerenkamp, Carsten; Massolle, Anja; Niehaus, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Neugebauer, Johannes; Studer, Armido; Eckert, Hellmut Antiferromagnetic ordering based on intermolecular London dispersion interactions in amphiphilic TEMPO ammonium salts. Physical chemistry chemical physics : PCCP 20(46) (2018) 28979-28983 Space group: P 1 21/c 1 Cell volume: 5851.1 Cell parameters: 25.2916; 18.5641; 12.4789; 90; 92.978; 90; |
| COD ID: 7231782 | |
| CIF file | Formula: - C27 H60 Cl N2 O3 - Comments: Exner, Jessica; Eusterwiemann, Steffen; Janka, Oliver; Doerenkamp, Carsten; Massolle, Anja; Niehaus, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Neugebauer, Johannes; Studer, Armido; Eckert, Hellmut Antiferromagnetic ordering based on intermolecular London dispersion interactions in amphiphilic TEMPO ammonium salts. Physical chemistry chemical physics : PCCP 20(46) (2018) 28979-28983 Space group: P 1 21/c 1 Cell volume: 3043.12 Cell parameters: 23.7688; 9.2641; 14.0543; 90; 100.476; 90; |
| COD ID: 7231783 | |
| CIF file | Formula: - C52.55 H108 F1.63 I1.46 N4 O3.63 S0.54 - Comments: Exner, Jessica; Eusterwiemann, Steffen; Janka, Oliver; Doerenkamp, Carsten; Massolle, Anja; Niehaus, Oliver; Daniliuc, Constantin G.; Pöttgen, Rainer; Neugebauer, Johannes; Studer, Armido; Eckert, Hellmut Antiferromagnetic ordering based on intermolecular London dispersion interactions in amphiphilic TEMPO ammonium salts. Physical chemistry chemical physics : PCCP 20(46) (2018) 28979-28983 Space group: P 1 21/c 1 Cell volume: 5960.6 Cell parameters: 25.5688; 18.6362; 12.5354; 90; 93.716; 90; |
| COD ID: 7231809 | |
| CIF file | Formula: - C27 H33 Cl N2 O4 - Comments: Leclaire, Nicolas A.; Li, Musen; Véron, Anna C; Neels, Antonia; Heier, Jakob; Reimers, Jeffrey R.; Nüesch, Frank A Cyanine platelet single crystals: growth, crystal structure and optical spectra. Physical chemistry chemical physics : PCCP 20(46) (2018) 29166-29173 Space group: P 1 21/c 1 Cell volume: 5139 Cell parameters: 15.9071; 20.7468; 15.6519; 90; 95.797; 90; |
| COD ID: 7231866 | |
| CIF file | Formula: - C106 H86 N8 P4 Re6 S8 - Comments: Li, Aisen; Wang, Jing; Liu, Yingjie; Xu, Shuping; Chu, Ning; Geng, Yijia; Li, Bao; Xu, Bin; Cui, Haining; Xu, Weiqing Remarkable pressure-induced emission enhancement based on intermolecular charge transfer in halogen bond-driven dual-component co-crystals. Physical chemistry chemical physics : PCCP 20(48) (2018) 30297-30303 Space group: P -1 Cell volume: 2497.7 Cell parameters: 12.5444; 13.067; 16.8159; 109.48; 95.962; 101.912; |
| COD ID: 7231867 | |
| CIF file | Formula: - F4 K Tm - Comments: Li, Aisen; Wang, Jing; Liu, Yingjie; Xu, Shuping; Chu, Ning; Geng, Yijia; Li, Bao; Xu, Bin; Cui, Haining; Xu, Weiqing Remarkable pressure-induced emission enhancement based on intermolecular charge transfer in halogen bond-driven dual-component co-crystals. Physical chemistry chemical physics : PCCP 20(48) (2018) 30297-30303 Space group: P 32 Cell volume: 1743.7 Cell parameters: 14.087; 14.087; 10.146; 90; 90; 120; |
| COD ID: 7231868 | |
| CIF file | Formula: - C16 H8 F4 I2 N2 - Comments: Li, Aisen; Wang, Jing; Liu, Yingjie; Xu, Shuping; Chu, Ning; Geng, Yijia; Li, Bao; Xu, Bin; Cui, Haining; Xu, Weiqing Remarkable pressure-induced emission enhancement based on intermolecular charge transfer in halogen bond-driven dual-component co-crystals. Physical chemistry chemical physics : PCCP 20(48) (2018) 30297-30303 Space group: P 1 21/c 1 Cell volume: 844.55 Cell parameters: 8.3599; 5.7208; 17.7679; 90; 96.344; 90; |
| COD ID: 7231869 | |
| CIF file | Formula: - C22 H8 F10 I2 N2 - Comments: Li, Aisen; Wang, Jing; Liu, Yingjie; Xu, Shuping; Chu, Ning; Geng, Yijia; Li, Bao; Xu, Bin; Cui, Haining; Xu, Weiqing Remarkable pressure-induced emission enhancement based on intermolecular charge transfer in halogen bond-driven dual-component co-crystals. Physical chemistry chemical physics : PCCP 20(48) (2018) 30297-30303 Space group: P 1 21/c 1 Cell volume: 1146.5 Cell parameters: 10.0768; 7.6435; 14.9092; 90; 93.245; 90; |
| COD ID: 7231870 | |
| CIF file | Formula: - C36 H56 Cd2 N20 - Comments: Mączka, Mirosław; Gągor, Anna; Ptak, Maciej; Stefańska, Dagmara; Sieradzki, Adam Temperature-dependent studies of a new two-dimensional cadmium dicyanamide framework exhibiting an unusual temperature-induced irreversible phase transition into a three-dimensional perovskite-like framework. Physical chemistry chemical physics : PCCP 20(47) (2018) 29951-29958 Space group: P 1 2/n 1 Cell volume: 1170.04 Cell parameters: 11.1924; 7.6769; 13.6278; 90; 92.252; 90; |
| COD ID: 7231871 | |
| CIF file | Formula: - C18 H28 Cd N10 - Comments: Mączka, Mirosław; Gągor, Anna; Ptak, Maciej; Stefańska, Dagmara; Sieradzki, Adam Temperature-dependent studies of a new two-dimensional cadmium dicyanamide framework exhibiting an unusual temperature-induced irreversible phase transition into a three-dimensional perovskite-like framework. Physical chemistry chemical physics : PCCP 20(47) (2018) 29951-29958 Space group: P 1 21/n 1 Cell volume: 2287.63 Cell parameters: 10.9243; 15.2819; 13.7228; 90; 93.079; 90; |
| COD ID: 7231872 | |
| CIF file | Formula: - C18 H28 Cd N10 - Comments: Mączka, Mirosław; Gągor, Anna; Ptak, Maciej; Stefańska, Dagmara; Sieradzki, Adam Temperature-dependent studies of a new two-dimensional cadmium dicyanamide framework exhibiting an unusual temperature-induced irreversible phase transition into a three-dimensional perovskite-like framework. Physical chemistry chemical physics : PCCP 20(47) (2018) 29951-29958 Space group: P -4 21 c Cell volume: 4657.89 Cell parameters: 16.2757; 16.2757; 17.5837; 90; 90; 90; |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!