Crystallography Open Database
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Searching journal of publication like 'Physical chemistry chemical physics : PCCP'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7219029 | CIF | C13 H24 K N O6 S | P 1 21/c 1 | 8.182; 14.222; 7.709 90; 98.717; 90 | 886.7 | Mandai, Toshihiko; Tsuzuki, Seiji; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Pentaglyme-K salt binary mixtures: phase behavior, solvate structures, and physicochemical properties. Physical chemistry chemical physics : PCCP, 2015, 17, 2838-2849 |
| 7219056 | CIF | C48 H48 N6 | P 1 21/n 1 | 9.85327; 11.5888; 34.7326 90; 95.691; 90 | 3946.48 | Abate, Antonio; Planells, Miquel; Hollman, Derek J.; Barthi, Vishal; Chand, Suresh; Snaith, Henry J.; Robertson, Neil Hole-transport materials with greatly-differing redox potentials give efficient TiO2-[CH3NH3][PbX3] perovskite solar cells. Physical chemistry chemical physics : PCCP, 2015, 17, 2335-2338 |
| 7219096 | CIF | C3 H7 N O2 | P 21 21 21 | 6.8141; 7.9189; 8.5887 90; 90; 90 | 463.45 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219097 | CIF | C3 H7 N O2 | P 21 21 21 | 6.797; 7.9162; 8.5951 90; 90; 90 | 462.47 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219098 | CIF | C3 H7 N O2 | P 21 21 21 | 6.7737; 7.917; 8.5989 90; 90; 90 | 461.14 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219099 | CIF | C3 H7 N O2 | P 21 21 21 | 6.7518; 7.9135; 8.6022 90; 90; 90 | 459.62 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219100 | CIF | C3 H7 N O2 | P 21 21 21 | 6.7285; 7.9107; 8.6056 90; 90; 90 | 458.05 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219101 | CIF | C3 H7 N O2 | P 21 21 21 | 6.7099; 7.909; 8.6098 90; 90; 90 | 456.91 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219102 | CIF | C3 H7 N O2 | P 21 21 21 | 6.6925; 7.9071; 8.6136 90; 90; 90 | 455.82 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219103 | CIF | C3 H7 N O2 | P 21 21 21 | 6.6768; 7.9039; 8.6154 90; 90; 90 | 454.66 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219104 | CIF | C3 H7 N O2 | P 21 21 21 | 6.6605; 7.9; 8.617 90; 90; 90 | 453.41 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219105 | CIF | C5 H11 N O2 | P n m a | 14.5652; 6.8755; 6.1405 90; 90; 90 | 614.93 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219106 | CIF | C5 H11 N O2 | P n m a | 14.5609; 6.8598; 6.129 90; 90; 90 | 612.19 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219107 | CIF | C5 H11 N O2 | P n m a | 14.5561; 6.8446; 6.1179 90; 90; 90 | 609.53 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219108 | CIF | C5 H11 N O2 | P n m a | 14.5514; 6.8288; 6.1066 90; 90; 90 | 606.8 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219109 | CIF | C5 H11 N O2 | P n m a | 14.5449; 6.8144; 6.0963 90; 90; 90 | 604.23 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219110 | CIF | C5 H11 N O2 | P n m a | 14.5416; 6.8003; 6.0871 90; 90; 90 | 601.94 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219111 | CIF | C5 H11 N O2 | P n m a | 14.5379; 6.7879; 6.0772 90; 90; 90 | 599.71 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219112 | CIF | C5 H11 N O2 | P n m a | 14.534; 6.777; 6.0668 90; 90; 90 | 597.56 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219113 | CIF | C5 H11 N O2 | P n m a | 14.5314; 6.7663; 6.0577 90; 90; 90 | 595.62 | Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V. Sarcosine and betaine crystals upon cooling: structural motifs unstable at high pressure become stable at low temperatures. Physical chemistry chemical physics : PCCP, 2015, 17, 3534-3543 |
| 7219138 | CIF | Ag Er0.02 Li Mo4 O16 Yb1.98 | I -4 | 5.151716; 5.151716; 11.26442 90; 90; 90 | 298.96 | Cheng, Fangrui; Xia, Zhiguo; Jing, Xiping; Wang, Ziyuan Li/Ag ratio dependent structure and upconversion photoluminescence of LixAg1-xYb0.99(MoO4)2:0.01Er(3+) phosphors. Physical chemistry chemical physics : PCCP, 2015, 17, 3689-3696 |
| 7219160 | CIF | C32 H18 F4 N4 O4 | P -1 | 6.8078; 10.6592; 10.84 61.373; 71.958; 84.063 | 655.6 | Rudloff, Milan; Ackermann, Kai; Huth, Michael; Jeschke, Harald O.; Tomic, Milan; Valentí, Roser; Wolfram, Benedikt; Bröring, Martin; Bolte, Michael; Chercka, Dennis; Baumgarten, Martin; Müllen, Klaus Charge transfer tuning by chemical substitution and uniaxial pressure in the organic complex tetramethoxypyrene-tetracyanoquinodimethane. Physical chemistry chemical physics : PCCP, 2015, 17, 4118-4126 |
| 7219187 | CIF | C29 H48 Br N5 O3 | P -1 | 8.0979; 10.1206; 20.3102 78.159; 88.1; 69.662 | 1526.23 | Wuckert, Eugen; Harjung, Marc D.; Kapernaum, Nadia; Mueller, Carsten; Frey, Wolfgang; Baro, Angelika; Giesselmann, Frank; Laschat, Sabine Photoresponsive ionic liquid crystals based on azobenzene guanidinium salts. Physical chemistry chemical physics : PCCP, 2015, 17, 8382-8392 |
| 7219188 | CIF | C31 H48 Cl7 N5 O2 | P 1 21/c 1 | 9.7566; 9.1438; 42.575 90; 91.25; 90 | 3797.3 | Wuckert, Eugen; Harjung, Marc D.; Kapernaum, Nadia; Mueller, Carsten; Frey, Wolfgang; Baro, Angelika; Giesselmann, Frank; Laschat, Sabine Photoresponsive ionic liquid crystals based on azobenzene guanidinium salts. Physical chemistry chemical physics : PCCP, 2015, 17, 8382-8392 |
| 7219328 | CIF | C13 H28 Br3 Cl N2 O2 | P 1 21/n 1 | 16.0589; 13.638; 18.3496 90; 95.258; 90 | 4001.9 | Rosokha, Sergiy V.; Traversa, Alfredo From charge transfer to electron transfer in halogen-bonded complexes of electrophilic bromocarbons with halide anions. Physical chemistry chemical physics : PCCP, 2015, 17, 4989-4999 |
| 7219329 | CIF | C13 H28 Br3 F I N | P n a 21 | 33.76; 8.427; 14.421 90; 90; 90 | 4103 | Rosokha, Sergiy V.; Traversa, Alfredo From charge transfer to electron transfer in halogen-bonded complexes of electrophilic bromocarbons with halide anions. Physical chemistry chemical physics : PCCP, 2015, 17, 4989-4999 |
| 7219330 | CIF | C14 H28 Br3 I N2 | P 1 21/n 1 | 8.5118; 18.3083; 13.3813 90; 97.315; 90 | 2068.32 | Rosokha, Sergiy V.; Traversa, Alfredo From charge transfer to electron transfer in halogen-bonded complexes of electrophilic bromocarbons with halide anions. Physical chemistry chemical physics : PCCP, 2015, 17, 4989-4999 |
| 7219575 | CIF | C46 H64 O4 S2 | P 1 21/c 1 | 8.972; 17.266; 14.26 90; 94.66; 90 | 2201.7 | Colella, L.; Brambilla, L.; Nardone, V.; Parisini, E.; Castiglioni, C.; Bertarelli, C. Outside rules inside: the role of electron-active substituents in thiophene-based heterophenoquinones. Physical chemistry chemical physics : PCCP, 2015, 17, 10426-10437 |
| 7219632 | CIF | C53 H89 Cl3 N26 O24 | P 1 21 1 | 14.6268; 18.3253; 15.3798 90; 118.011; 90 | 3639.5 | Xiao, Xin; Gao, Zhong-Zheng; Shan, Cheng-Long; Tao, Zhu; Zhu, Qian-Jiang; Xue, Sai-Feng; Liu, Jing-Xin Encapsulation of haloalkane 1-(3-chlorophenyl)-4-(3-chloropropyl)-piperazinium in symmetrical α,α',δ,δ'-tetramethyl-cucurbit[6]uril. Physical chemistry chemical physics : PCCP, 2015, 17, 8618-8621 |
| 7219831 | CIF | C20 H19 B F2 N2 O2 | P -1 | 8.3643; 9.794; 11.596 79.79; 71.08; 87.2 | 884.4 | Luo, Geng-Geng; Lu, Hui; Zhang, Xiao-Long; Dai, Jing-Cao; Wu, Ji-Huai; Wu, Jia-Jia The relationship between the boron dipyrromethene (BODIPY) structure and the effectiveness of homogeneous and heterogeneous solar hydrogen-generating systems as well as DSSCs. Physical chemistry chemical physics : PCCP, 2015, 17, 9716-9729 |
| 7219832 | CIF | C20 H17 B F2 I2 N2 O2 | P -1 | 7.747; 10.414; 14.007 91.746; 105.965; 91.149 | 1085.5 | Luo, Geng-Geng; Lu, Hui; Zhang, Xiao-Long; Dai, Jing-Cao; Wu, Ji-Huai; Wu, Jia-Jia The relationship between the boron dipyrromethene (BODIPY) structure and the effectiveness of homogeneous and heterogeneous solar hydrogen-generating systems as well as DSSCs. Physical chemistry chemical physics : PCCP, 2015, 17, 9716-9729 |
| 7219833 | CIF | C21 H19 B F2 I2 N2 O2 | P -1 | 10.0744; 10.408; 11.805 69.844; 85.884; 68.191 | 1076.58 | Luo, Geng-Geng; Lu, Hui; Zhang, Xiao-Long; Dai, Jing-Cao; Wu, Ji-Huai; Wu, Jia-Jia The relationship between the boron dipyrromethene (BODIPY) structure and the effectiveness of homogeneous and heterogeneous solar hydrogen-generating systems as well as DSSCs. Physical chemistry chemical physics : PCCP, 2015, 17, 9716-9729 |
| 7219903 | CIF | B5 H3 O11 Sr2 | C 1 2 1 | 10.2342; 8.024; 6.3898 90; 127.882; 90 | 414.15 | Zhang, Fangyuan; Zhang, Fangfang; Qun, Jing; Pan, Shilie; Yang, Zhihua; Jia, Dianzeng Synthesis, characterization and theoretical studies of nonlinear optical crystal Sr2B5O9(OH)·H2O. Physical chemistry chemical physics : PCCP, 2015, 17, 10489-10496 |
| 7219973 | CIF | C12 H10 O2.4 | P 1 21/n 1 | 15.074; 3.9014; 17.001 90; 110.532; 90 | 936.3 | Manolova, Y.; Kurteva, V.; Antonov, L.; Marciniak, H.; Lochbrunner, S.; Crochet, A.; Fromm, K. M.; Kamounah, F. S.; Hansen, P. E. 4-Hydroxy-1-naphthaldehydes: proton transfer or deprotonation. Physical chemistry chemical physics : PCCP, 2015, 17, 10238-10249 |
| 7220032 | CIF | C25 H22 N3 O S6 Yb | P 1 21/c 1 | 8.07021; 19.1975; 17.7338 90; 93.6245; 90 | 2741.96 | Ilichev, Vasily A.; Pushkarev, Anatoly P.; Rumyantcev, Roman V.; Yablonskiy, Artem N.; Balashova, Tatyana V.; Fukin, Georgy K.; Grishin, Dmitry F.; Andreev, Boris A.; Bochkarev, Mikhail N. Luminescent properties of 2-mercaptobenzothiazolates of trivalent lanthanides. Physical chemistry chemical physics : PCCP, 2015, 17, 11000-11005 |
| 7220415 | CIF | C4 H4 N8 | P 1 21/n 1 | 4.9579; 6.4613; 10.181 90; 92.28; 90 | 325.88 | Wu, L.-C.; Chung, W.-C.; Wang, C.-C.; Lee, G.-H.; Lu, S.-I.; Wang, Y. A charge density study of π-delocalization and intermolecular interactions. Physical chemistry chemical physics : PCCP, 2015, 17, 14177-14184 |
| 7220416 | CIF | C26 H18 O4 | P -1 | 3.8538; 10.179; 13 97.18; 96.03; 100.6 | 493 | Arendt, Agata; Kołkowski, Radosław; Samoc, Marek; Szafert, Sławomir Spectral dependence of nonlinear optical properties of symmetrical octatetraynes with p-substituted phenyl end-groups. Physical chemistry chemical physics : PCCP, 2015, 17, 13680-13688 |
| 7220417 | CIF | C24 H14 O4 | C 1 2/c 1 | 40.449; 3.8627; 11.605 90; 94.87; 90 | 1806.6 | Arendt, Agata; Kołkowski, Radosław; Samoc, Marek; Szafert, Sławomir Spectral dependence of nonlinear optical properties of symmetrical octatetraynes with p-substituted phenyl end-groups. Physical chemistry chemical physics : PCCP, 2015, 17, 13680-13688 |
| 7220418 | CIF | C11 H18 F6 N2 O5 S2 | P -1 | 14.282; 17.055; 17.128 60.5; 82.665; 89.096 | 3596.1 | Yao, Wenzhi; Kelley, Steven P.; Rogers, Robin D.; Vaid, Thomas P. Electrical conductivity in two mixed-valence liquids. Physical chemistry chemical physics : PCCP, 2015, 17, 14107-14114 |
| 7220453 | CIF | C77 H67 Cl2 N5 Zn | P 1 21/a 1 | 17.737; 18.295; 19.069 90; 92.168; 90 | 6183.4 | Saegusa, Yuta; Ishizuka, Tomoya; Komamura, Keiyu; Shimizu, Soji; Kotani, Hiroaki; Kobayashi, Nagao; Kojima, Takahiko Ring-fused porphyrins: extension of π-conjugation significantly affects the aromaticity and optical properties of the porphyrin π-systems and the Lewis acidity of the central metal ions. Physical chemistry chemical physics : PCCP, 2015, 17, 15001-15011 |
| 7220454 | CIF | C71 H76 N4 O5 Zn | P 1 21/a 1 | 19.126; 17.2247; 19.215 90; 93.303; 90 | 6319.7 | Saegusa, Yuta; Ishizuka, Tomoya; Komamura, Keiyu; Shimizu, Soji; Kotani, Hiroaki; Kobayashi, Nagao; Kojima, Takahiko Ring-fused porphyrins: extension of π-conjugation significantly affects the aromaticity and optical properties of the porphyrin π-systems and the Lewis acidity of the central metal ions. Physical chemistry chemical physics : PCCP, 2015, 17, 15001-15011 |
| 7220455 | CIF | C53 H21 F12 N5 Zn | P -1 | 16.724; 16.971; 20.045 107.054; 107.58; 105.011 | 4793 | Saegusa, Yuta; Ishizuka, Tomoya; Komamura, Keiyu; Shimizu, Soji; Kotani, Hiroaki; Kobayashi, Nagao; Kojima, Takahiko Ring-fused porphyrins: extension of π-conjugation significantly affects the aromaticity and optical properties of the porphyrin π-systems and the Lewis acidity of the central metal ions. Physical chemistry chemical physics : PCCP, 2015, 17, 15001-15011 |
| 7220526 | CIF | Cu2 Se4 Sn Zn | I -4 2 m | 5.69647; 5.69647; 11.3394 90; 90; 90 | 367.961 | Choubrac, Léo; Lafond, Alain; Paris, Michaël; Guillot-Deudon, Catherine; Jobic, Stéphane The stability domain of the selenide kesterite photovoltaic materials and NMR investigation of the Cu/Zn disorder in Cu2ZnSnSe4 (CZTSe). Physical chemistry chemical physics : PCCP, 2015, 17, 15088-15092 |
| 7220573 | CIF | C12 H13 N3 O7 | P 1 21/c 1 | 10.056; 15.875; 9.709 90; 115.617; 90 | 1398 | Bera, Santu; Ambast, Deepak K. S.; Pal, Bipul; Haldar, Debasish Assembly, growth and nonlinear thermo-optical properties of nitropeptides. Physical chemistry chemical physics : PCCP, 2015, 17, 16983-16990 |
| 7220574 | CIF | C13 H13 N3 O9 | P 21 21 21 | 4.895; 12.127; 27.29 90; 90; 90 | 1620 | Bera, Santu; Ambast, Deepak K. S.; Pal, Bipul; Haldar, Debasish Assembly, growth and nonlinear thermo-optical properties of nitropeptides. Physical chemistry chemical physics : PCCP, 2015, 17, 16983-16990 |
| 7220575 | CIF | C14 H15 N3 O9 | P 21 21 21 | 8.759; 12.834; 30.603 90; 90; 90 | 3440 | Bera, Santu; Ambast, Deepak K. S.; Pal, Bipul; Haldar, Debasish Assembly, growth and nonlinear thermo-optical properties of nitropeptides. Physical chemistry chemical physics : PCCP, 2015, 17, 16983-16990 |
| 7220580 | CIF | C2 Cl2 F N S | P 21 21 21 | 5.9327; 8.3874; 11.5697 90; 90; 90 | 575.707 | Berrueta Martínez, Y; Rodríguez Pirani, L S; Erben, M. F.; Reuter, C. G.; Vishnevskiy, Y. V.; Stammler, H. G.; Mitzel, N. W.; Della Védova, C O The structure of chloromethyl thiocyanate, CH2ClSCN, in gas and crystalline phases. Physical chemistry chemical physics : PCCP, 2015, 17, 15805-15812 |
| 7220643 | CIF | C35 H32 Eu F9 O11 S | P -1 | 11.1497; 13.5201; 14.2594 75.358; 74.28; 83.906 | 2000.3 | Zhu, Tianyu; Chen, Peng; Li, Hongfeng; Sun, Wenbin; Gao, Ting; Yan, Pengfei Structural effects on the photophysical properties of mono-β-diketonate and bis-β-diketonate Eu(III) complexes. Physical chemistry chemical physics : PCCP, 2015, 17, 16136-16144 |
| 7220644 | CIF | C74 H66 Eu2 F18 O22 S4 | C 1 2/c 1 | 22.453; 23.9254; 19.4634 90; 122.737; 90 | 8794.9 | Zhu, Tianyu; Chen, Peng; Li, Hongfeng; Sun, Wenbin; Gao, Ting; Yan, Pengfei Structural effects on the photophysical properties of mono-β-diketonate and bis-β-diketonate Eu(III) complexes. Physical chemistry chemical physics : PCCP, 2015, 17, 16136-16144 |
| 7220700 | CIF | C11 H11 N5 O7 | P -1 | 7.3233; 9.6646; 10.3323 78.588; 80.835; 85.796 | 707.02 | Panja, Sumit Kumar; Dwivedi, Nidhi; Noothalapati, Hemanth; Shigeto, Shinsuke; Sikder, A. K.; Saha, Abhijit; Sunkari, Sailaja S.; Saha, Satyen Significance of weak interactions in imidazolium picrate ionic liquids: spectroscopic and theoretical studies for molecular level understanding. Physical chemistry chemical physics : PCCP, 2015, 17, 18167-18177 |
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