Crystallography Open Database
Search results
Result: there are 385 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 journal of publication like 'Phys. Chem. Chem. Phys.'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7213065 | CIF | C19 H17 N3 O5 | P -1 | 12.812; 9.449; 8.199 111.55; 74.84; 111.21 | 851.1 | Hobley, Jonathan; Malatesta, Vincenzo; Millini, Roberto; Montanari, Luciano; O Neil Parker, Jr, Wallace Proton exchange and isomerisation reactions of photochromic and reverse photochromic spiro-pyrans and their merocyanine forms Physical Chemistry Chemical Physics, 1999, 1, 3259 |
| 7217109 | CIF | C3 H5 N3 | P c c n | 10.468; 13.484; 5.7549 90; 90; 90 | 812.3 | Antonio Jime´nez, Jose´; María Claramunt, Rosa; Mó, Otilia; Yáñez, Manuel; Wehrmann, Frank; Buntkowsky, Gerd; Limbach, Hans-Heinrich; Goddard, Richard; Elguero, Jose´ The structure of N-aminopyrazole in the solid state and in solution: an experimental and computational study Physical Chemistry Chemical Physics, 1999, 1, 5113 |
| 7217110 | CIF | C70 H79 Cl N5 Na O8 | P 4 c c | 21.791; 21.791; 26.958 90; 90; 90 | 12801 | Danil de Namor, Angela F.; Castellano, Eduardo E.; Pulcha Salazar, Lupe E.; Piro, Oscar E.; Jafou, Olga Thermodynamics of cation (alkali-metal) complexation by 5,11,17,23-tetra-tert-butyl[25,26,27,28-tetrakis(2-pyridylmethyl)oxy]- calix(4)arene and the crystal structure‒superstructure of its 1:1 complex with sodium and acetonitrile Physical Chemistry Chemical Physics, 1999, 1, 285 |
| 7217111 | CIF | C8 H16 N2 O4 | P 1 21/c 1 | 8.0254; 7.4851; 17.7967 90; 90.98; 90 | 1068.9 | Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements Physical Chemistry Chemical Physics, 1999, 1, 1469 |
| 7217112 | CIF | C4 H10 N O3 | P b c n | 21.6397; 8.3029; 7.1004 90; 90; 90 | 1275.7 | Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements Physical Chemistry Chemical Physics, 1999, 1, 1469 |
| 7217113 | CIF | C50 H61 F O4 | P 4/n :2 | 12.8581; 12.8581; 13.2833 90; 90; 90 | 2196.14 | Brouwer, Eric B.; Gougeon, Regis D. M.; Hirschinger, Je´rôme; Udachin, Kostantin A.; Harris, Robin K.; Ripmeester, John A. Intermolecular distance measurements in supramolecular solids: 13C‒19F REDOR NMR spectroscopy of p-tert-butylcalix[4]arene‒fluorobenzene Physical Chemistry Chemical Physics, 1999, 1, 4043 |
| 7221277 | CIF | Ca10 H2 O26 V6 | P 63/m | 9.7405; 9.7405; 7.004 90; 90; 120 | 575.492 | Bauer Boechat, C.; Eon, J.G.; da Silva San Gil, R.A.; Malta Rossi, A.; de Castro Perez, C.A. Structure of vanadate in calcium phosphate and vanadate apatite solid solutions Physical Chemistry Chemical Physics, 2000, 2, 4225-4230 |
| 7221305 | CIF | C Cl N O2 S2 | P c a 21 | 13.89; 7.286; 5.172 90; 90; 90 | 523.42 | Romano, R.M.; Della Vedova, C.O.; Boese, R.; Hildebrandt, P. Structural and spectroscopic characterization of Cl C (O) S N S O. A theoretical and experimental study Physical Chemistry Chemical Physics, 1999, 1, 2551-2557 |
| 7221623 | CIF HKL | Al6 Ca4 F2 O12 | R -3 :H | 17.323748; 17.323748; 7.000171 90; 90; 120 | 1819.38 | Zhiguo, Xia; Molokeev, Maxim; Oreshonkov, Alexander; Atuchin, Victor; Ru-Shi, Liu; Cheng, Dong Crystal and local structure refinement in Ca2Al3O6F explored by X-ray diffraction and Raman spectroscopy Physical Chemistry Chemical Physics, 2014, 16, 5952 |
| 7222335 | CIF | C12.864 Al54.0096 Cl36.864 F12.864 Na47.808 O384 Si137.99 | F d -3 m :2 | 24.76; 24.76; 24.76 90; 90; 90 | 15179.3 | Mellot-Draznieks, C.; Rodriguez-Carvajal, J.; Cox, D.E.; Cheetham, A.K. Adsorption of chlorofluorocarbons in nanoporous solids: a combined powder neutron diffraction and computational study of C F Cl3 in NaY zeolite Physical Chemistry Chemical Physics, 2003, 5, 1882-1887 |
| 7222416 | CIF | Mo0.12 O5 V1.88 | P m m n :2 | 11.5439; 3.5714; 4.3362 90; 90; 90 | 178.772 | Haas, F.; Fuess, H.; Adams, A.H.; Schimanke, G.; Martin, M.; Buhrmester, T. X-ray absorption and X-ray diffraction studies on molybdenum doped vanadium pentoxide Physical Chemistry Chemical Physics, 2003, 5, 4317-4324 |
| 7222419 | CIF | Na3 O4 P | F m -3 m | 7.5438; 7.5438; 7.5438 90; 90; 90 | 429.309 | Harrison, R.J.; Putnis, A.; Kockelmann, W. Phase transition behaviour and equilibrium phase relations in the fast-ion conductor system (Na3 P O4) - (Na2 S O4) Physical Chemistry Chemical Physics, 2002, 4, 3252-3259 |
| 7223849 | CIF | C10 H20 Cl N | P 21 21 21 | 8.1634; 8.9539; 14.4292 90; 90; 90 | 1054.69 | Clough, Matthew T.; Geyer, Karolin; Hunt, Patricia A.; McIntosh, Alastair J. S.; Rowe, Rebecca; Welton, Tom; White, Andrew J. P. Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts Phys. Chem. Chem. Phys., 2016 |
| 7223850 | CIF | C8 H18 Cl N O | P b c a | 12.5408; 11.0072; 14.1345 90; 90; 90 | 1951.11 | Clough, Matthew T.; Geyer, Karolin; Hunt, Patricia A.; McIntosh, Alastair J. S.; Rowe, Rebecca; Welton, Tom; White, Andrew J. P. Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts Phys. Chem. Chem. Phys., 2016 |
| 7225871 | CIF | C5 H9 Cl4 Fe N2 | P 21 21 21 | 9.1242; 13.8132; 9.0359 90; 90; 90 | 1138.83 | de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid Phys. Chem. Chem. Phys., 2016 |
| 7225872 | CIF | C5 H9 Cl4 Fe N2 | P 1 21/c 1 | 14.1391; 13.7039; 13.2935 90; 115.539; 90 | 2324.09 | de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid Phys. Chem. Chem. Phys., 2016 |
| 7225873 | CIF | C5 H9 Cl4 Fe N2 | P 1 21 1 | 6.5434; 14.0286; 6.5314 90; 89.921; 90 | 599.55 | de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid Phys. Chem. Chem. Phys., 2016 |
| 7226004 | CIF | C84 H122 N4 O17 S Si2 Zn | P -1 | 11.4105; 17.6824; 22.7971 79.762; 89.224; 74.592 | 4361 | Alam, Md. M.; Bolze, F.; Daniel, C.; Flamigni, L.; Gourlaouen, C.; Heitz, V.; Jenni, S.; Schmitt, J.; Sour, A.; Ventura, B. π-Extended diketopyrrolopyrrole‒porphyrin arrays: one- and two-photon photophysical investigations and theoretical studies Phys. Chem. Chem. Phys., 2016 |
| 7226121 | CIF HKL | Bi2 Ca | C m c m | 4.697; 17.069; 4.6127 90; 90; 90 | 369.81 | Winiarski, M.J.; Wiendlocha, B.; Golab, S.; Kushwaha, S.K.; Wisniewski, P.; Kaczorowski, D.; Thompson, J.D.; Cava, R.J.; Klimczuk, T. Superconductivity in CaBi2 Physical Chemistry Chemical Physics, 2016, 18, 21737-21745 |
| 7228030 | CIF | C25 H22 N2 | P -1 | 8.1532; 10.2921; 12.9838 66.763; 88.564; 73.285 | 953.98 | Fu, Hongyu; Xu, Ning; Pan, Yi-Ming; Lu, Xiao-Lin; Xia, Min Emission behaviours of novel V- and X-shaped fluorophores in response to pH and force stimuli Phys. Chem. Chem. Phys., 2017 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!