Crystallography Open Database
Search results
Result: there are 4409 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching volume of publication is 5
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 7236997 | CIF | C25 H23 N O5 S | P 1 n 1 | 11.6942; 7.069; 13.1573 90; 101.21; 90 | 1066.91 | Choi, Jae-Young; Lee, Seung-Jun; Lee, Seung-Chul; Jeong, Chan-Uk; Jazbinsek, Mojca; Yun, Hoseop; Kang, Bong Joo; Rotermund, Fabian; Kwon, O-Pil Quinolinium single crystals with a high optical nonlinearity and unusual out-of-plane polar axis Journal of Materials Chemistry C, 2017, 5, 12602 |
| 7252066 | CIF | C8 Ca5 Na6 O24 | P 63 m c | 10.0708; 10.0708; 12.604 90; 90; 120 | 1107 | Song, Yunxia; Luo, Min; Zhao, Dan; Peng, Guang; Lin, Chensheng; Ye, Ning Explorations of new UV nonlinear optical materials in the Na2CO3-CaCO3 system Journal of Materials Chemistry C, 2017, 5, 8758 |
| 8000197 | CIF | C144 H162 Ag6.66 Au18.34 S18 | P -1 | 16.191; 17.244; 18.613 105.871; 106.252; 90.74 | 4776 | Kumara, Chanaka; Aikens, Christine M.; Dass, Amala X-ray Crystal Structure and Theoretical Analysis of Au25‒xAgx(SCH2CH2Ph)18‒Alloy The Journal of Physical Chemistry Letters, 2014, 5, 461 |
| 8000198 | CIF | C14 H12.8 N4 O1.4 | P 1 21/c 1 | 8.761; 16.167; 9.689 90; 108.314; 90 | 1302.8 | Fang, Xinxiu; Wang, Yan; Wang, Dan; Zhao, Guiyan; Zhang, Wenwen; Ren, Aimin; Wang, Haiyu; Xu, Jingwei; Gao, Bing-Rong; Yang, Wei Synthesized Blue Fluorescent Protein Analogue with Tunable Colors from Excited-State Intramolecular Proton Transfer through an N‒H···N Hydrogen Bond The Journal of Physical Chemistry Letters, 2014, 5, 92 |
| 8000199 | CIF | C14 H12 N4 O | P -1 | 7.5326; 9.6002; 10.1649 99.619; 109.189; 109.599 | 621.42 | Fang, Xinxiu; Wang, Yan; Wang, Dan; Zhao, Guiyan; Zhang, Wenwen; Ren, Aimin; Wang, Haiyu; Xu, Jingwei; Gao, Bing-Rong; Yang, Wei Synthesized Blue Fluorescent Protein Analogue with Tunable Colors from Excited-State Intramolecular Proton Transfer through an N–H···N Hydrogen Bond The Journal of Physical Chemistry Letters, 2014, 5, 92 |
| 8000200 | CIF | C14 H3 F7 O2 | P 21 21 21 | 4.4782; 11.8813; 21.849 90; 90; 90 | 1162.5 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000201 | CIF | C44 Cs Er F52 O8 | P n n a | 26.1476; 14.1409; 14.6773 90; 90; 90 | 5426.9 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000202 | CIF | C58 H14 Cs Er F28 O8 | C 1 2/c 1 | 26.905; 8.464; 24.2743 90; 107.21; 90 | 5280.3 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000203 | CIF | C56 Cs Er F28 O12 | P -1 | 13.2677; 14.96; 15.5993 99.293; 101.038; 115.265 | 2643.1 | Peng, Yu; Ye, Huanqing; Li, Zhe; Motevalli, Majid; Hernández, Ignacio; Gillin, William P.; Wyatt, Peter B. Visible-Range Sensitization of Er3±Based Infrared Emission from Perfluorinated 2-Acylphenoxide Complexes The Journal of Physical Chemistry Letters, 2014, 5, 1560 |
| 8000206 | CIF | C46 H54 O2 S4 | P -1 | 5.8691; 14.2212; 14.2606 113.921; 100.286; 93.039 | 1060.1 | Nicolini, Tommaso; Famulari, Antonino; Gatti, Teresa; Martí-Rujas, Javier; Villafiorita-Monteleone, Francesca; Canesi, Eleonora V.; Meinardi, Francesco; Botta, Chiara; Parisini, Emilio; Meille, Stefano Valdo; Bertarelli, Chiara Structure–Photoluminescence Correlation for Two Crystalline Polymorphs of a Thiophene–Phenylene Co-Oligomer with Bulky Terminal Substituents The Journal of Physical Chemistry Letters, 2014, 5, 2171 |
| 8000207 | CIF | C23 H27 O S2 | P -1 | 10.0773; 12.626; 17.705 82.176; 77.112; 76.89 | 2130 | Nicolini, Tommaso; Famulari, Antonino; Gatti, Teresa; Martí-Rujas, Javier; Villafiorita-Monteleone, Francesca; Canesi, Eleonora V.; Meinardi, Francesco; Botta, Chiara; Parisini, Emilio; Meille, Stefano Valdo; Bertarelli, Chiara Structure–Photoluminescence Correlation for Two Crystalline Polymorphs of a Thiophene–Phenylene Co-Oligomer with Bulky Terminal Substituents The Journal of Physical Chemistry Letters, 2014, 5, 2171 |
| 8000208 | CIF | C32 H36 N2 | P -1 | 6.202; 8.602; 12.334 83.36; 79.79; 73.78 | 620.3 | Chen, Jinlong; Ma, Suqian; Zhang, Jibo; Wang, Lijuan; Ye, Ling; Li, Bao; Xu, Bin; Tian, Wenjing Proton-Triggered Hypsochromic Luminescence in 1,1′-(2,5-Distyryl-1,4-phenylene) Dipiperidine The Journal of Physical Chemistry Letters, 2014, 5, 2781 |
| 9005119 | CIF | Al0.16 Ca0.764 F0.33 Fe0.24 H1.67 K0.21 Mg4.22 Mn0.802 Na1.574 O23.67 Si7.92 | C 1 2/m 1 | 9.891; 18.018; 5.276 90; 104.15; 90 | 911.739 | Oberti, R.; Hawthorne, F. C.; Ungaretti, L.; Cannillo, E. The behaviour of Mn in amphiboles: Mn in richerite Sample: MR(1) European Journal of Mineralogy, 1993, 5, 43-51 |
| 9005120 | CIF | Al0.14 Ca0.75 F0.34 Fe0.24 H1.66 K0.2 Mg4.28 Mn0.81 Na1.62 O23.66 Si7.9 | C 1 2/m 1 | 9.892; 18.027; 5.278 90; 104.09; 90 | 912.873 | Oberti, R.; Hawthorne, F. C.; Ungaretti, L.; Cannillo, E. The behaviour of Mn in amphiboles: Mn in richerite Sample: MR(2) European Journal of Mineralogy, 1993, 5, 43-51 |
| 9005121 | CIF | Al0.2 Ca0.88 F0.3 Fe0.24 H1.7 K0.24 Mg4.28 Mn0.75 Na1.5 O23.7 Si7.84 | C 1 2/m 1 | 9.909; 18.03; 5.278 90; 104.23; 90 | 914.03 | Oberti, R.; Hawthorne, F. C.; Ungaretti, L.; Cannillo, E. The behaviour of Mn in amphiboles: Mn in richerite Sample: MR(3) European Journal of Mineralogy, 1993, 5, 43-51 |
| 9005122 | CIF | Al0.12 Ca0.92 F0.35 Fe0.2 H1.65 K0.35 Mg3.97 Mn0.95 Na1.45 O23.65 Si7.94 | C 1 2/m 1 | 9.966; 18.066; 5.279 90; 104.4; 90 | 920.601 | Oberti, R.; Hawthorne, F. C.; Ungaretti, L.; Cannillo, E. The behaviour of Mn in amphiboles: Mn in richerite Sample: MR(4) European Journal of Mineralogy, 1993, 5, 43-51 |
| 9005123 | CIF | Al0.12 Ca0.92 F0.35 Fe0.2 H1.65 K0.35 Mg3.97 Mn0.95 Na1.45 O23.65 Si7.94 | C 1 2/m 1 | 9.974; 18.078; 5.282 90; 104.36; 90 | 922.641 | Oberti, R.; Hawthorne, F. C.; Ungaretti, L.; Cannillo, E. The behaviour of Mn in amphiboles: Mn in richerite Sample: MR(5) using occupancies from MR(4) European Journal of Mineralogy, 1993, 5, 43-51 |
| 9005124 | CIF | Ca3 Fe2 O12 Si3 | I a -3 d | 12.051; 12.051; 12.051 90; 90; 90 | 1750.13 | Armbruster, T.; Geiger, C. A. Andradite crystal chemistry, dynamic X-site disorder and structural strain in silicate garnets Sample: T = 100K European Journal of Mineralogy, 1993, 5, 59-71 |
| 9005125 | CIF | Ca3 Fe2 O12 Si3 | I a -3 d | 12.056; 12.056; 12.056 90; 90; 90 | 1752.31 | Armbruster, T.; Geiger, C. A. Andradite crystal chemistry, dynamic X-site disorder and structural strain in silicate garnets Sample: T = 200K European Journal of Mineralogy, 1993, 5, 59-71 |
| 9005126 | CIF | Ca3 Fe2 O12 Si3 | I a -3 d | 12.063; 12.063; 12.063 90; 90; 90 | 1755.36 | Armbruster, T.; Geiger, C. A. Andradite crystal chemistry, dynamic X-site disorder and structural strain in silicate garnets Sample: T = 293K European Journal of Mineralogy, 1993, 5, 59-71 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

