Crystallography Open Database
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Searching space group like 'P c c a'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1007092 | CIF | Ag O9 P3 Zn | P c c a | 13.95; 10.735; 9.951 90; 90; 90 | 1490.2 | Averbuch-Pouchot, M T; Durif, A Crystal Chemistry of M(II) Ag (P O~3~)~3~ Polyphosphates for M(II) = Zn,Co,Ni,Mg and M(II)~4~ Na~4~ (P~4~ O~12~)~3~ Tetrametaphosphates for M(II)=Zn,Co,Ni: Crystal Structures of Zn Ag (P O~3~)~3~ and Zn~4~ Na~4~ (P~4~ O~12~)~3~ Journal of Solid State Chemistry, 1983, 49, 341-352 |
| 1502624 | CIF | C48 H49 Fe Lu N2 O | P c c a | 20.6899; 23.815; 16.4542 90; 90; 90 | 8107.5 | Diaconescu, Paula L. Reactions of aromatic N-heterocycles with d0fn-metal alkyl complexes supported by chelating diamide ligands. Accounts of chemical research, 2010, 43, 1352-1363 |
| 1504687 | CIF | C17 H28 O4 | P c c a | 24.6936; 6.3812; 10.2586 90; 90; 90 | 1616.5 | Ghorai, Prasanta; Dussault, Patrick H.; Hu, Chunhua Synthesis of spiro-bisperoxyketals. Organic letters, 2008, 10, 2401-2404 |
| 1508065 | CIF | C46 H16 F8 N10 Zn | P c c a | 22.857; 12.614; 14.604 90; 90; 90 | 4210.6 | Shimomura, Satoru; Higuchi, Masakazu; Matsuda, Ryotaro; Yoneda, Ko; Hijikata, Yuh; Kubota, Yoshiki; Mita, Yoshimi; Kim, Jungeun; Takata, Masaki; Kitagawa, Susumu Selective sorption of oxygen and nitric oxide by an electron-donating flexible porous coordination polymer. Nature chemistry, 2010, 2, 633-637 |
| 1509458 | CIF | Ag Mg O9 P3 | P c c a | 13.888; 10.7302; 9.97301 90; 90; 90 | 1486.19 | Maazaz, M.; Belharouak, I.; Tanguy, B.; Aouad, H.; Gravereau, P.; le Flem, G.; Mesnaoui, M.; Parent, C. Crystal structure and luminescence properties of silver in Ag M (P O3)3 (M= Mg, Zn, Ba) polyphosphates Journal of Solid State Chemistry, 1999, 145, 97-103 |
| 1510376 | CIF | Au2 Cd2 Rb2 S4 | P c c a | 13.93; 5.757; 6.742 90; 90; 90 | 540.675 | Kanatzidis, M.G.; Axtell, E.A. First examples of gold thiocadmates: A2 Au2 Cd2 S4 (A = rb, Cs) and K2 Au4 Cd S4 : bright photoluminescence from new alkali metal/gold thiocadmates Chemistry - A European Journal, 1998, 4, 2435-2441 |
| 1511679 | CIF | B7 La2 Re3 | P c c a | 7.681; 6.773; 11.658 90; 90; 90 | 606.489 | Mikhailenko, S.I.; Yarmolyuk, Ya.P.; Kuz'ma, Yu.B.; Kotur, B.Ya. The crystal structure of boride La2 Re3 B7 Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya B: Geologichni, Khimichni ta Biologichni Nauki, 1982, 1982, 25-28 |
| 1514519 | CIF | C62 H135 Mn Mo6 N6 O26 | P c c a | 23.3192; 28.2; 30.215 90; 90; 90 | 19869 | Yvon, Carine; Macdonell, Andrew; Buchwald, Saskia; Surman, Andrew J.; Follet, Noémie; Alex, Jennifer; Long, De-Liang; Cronin, Leroy A collection of robust methodologies for the preparation of asymmetric hybrid Mn‒Anderson polyoxometalates for multifunctional materials Chemical Science, 2013, 4, 3810 |
| 1520340 | CIF | C40 H44 Br1.32 Cl0.68 O6 S32 | P c c a | 32.736; 6.6793; 14.7618 90; 90; 90 | 3227.7 | Martin, Lee; Horton, Peter N.; Hursthouse, Michael B. C40H44Br1.32Cl0.68O6S32 Crystal Structure Report Archive, 2009, 1233 |
| 1520541 | CIF | Cu4 O21 P6 Tl4 | P c c a | 20.171; 10.558; 9.676 90; 90; 90 | 2060.7 | M Fakhfakh; S Ammar-Merah; N Jouini The compound Tl4Cu4(P2O7)3, a new three-dimensional structure with interconnected tunnels Solid State Sciences, 2000, 2, 587-594 |
| 1521085 | CIF | C K La O4 | P c c a | 5.6793; 12.3841; 5.6793 90; 90; 90 | 399.442 | Guenther, W.; Paulus, W.; Schoellhorn, R. Stacking disorder in a layered carbonate phase: the structure of LaK O C O3 Journal of Physics and Chemistry of Solids, 2000, 61, 1945-1953 |
| 1524033 | CIF | Cl3 D4 Fe O2 Rb | P c c a | 8.876; 6.8724; 11.1807 90; 90; 90 | 682.016 | Basten, J.A.J.; de Jonge, W.J.M.; van Vlimmeren, Q.A.G. Crystallographic and magnetic structure of rubidium iron trichloride dideuterate and cesium iron trichloride dideuterate Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1978, 18, 2179-2184 |
| 1524034 | CIF | Cl3 Cs D4 Fe O2 | P c c a | 8.9809; 7.2132; 11.3867 90; 90; 90 | 737.642 | Basten, J.A.J.; van Vlimmeren, Q.A.G.; de Jonge, W.J.M. Crystallographic and magnetic structure of rubidium iron trichloride dideuterate and cesium iron trichloride dideuterate Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1978, 18, 2179-2184 |
| 1533108 | CIF | Br F8 Sb | P c c a | 10.12; 5.81; 10.95 90; 90; 90 | 643.829 | Edwards, A.J.; Jones, G.R. Fluoride crystal structures. Part VI. Difluorobromine(III) hexafluoroantimonate(V) Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1969, 1969, 1467-1470 |
| 1535788 | CIF | Mo6 Na3 O24 Rb3 Sc2 | P c c a | 10.795; 12.497; 18.652 90; 90; 90 | 2516.25 | Tursina, A.I.; Trunov, V.K.; Efremov, V.A.; Gasanov, Yu.M. Crystal structure of Rb3 Na3 Sc2 (Mo O4)6 Kristallografiya, 1990, 35, 625-629 |
| 1536700 | CIF | Cl F8 Nb | P c c a | 9.981; 5.781; 10.522 90; 90; 90 | 607.121 | Ellern, A.M.; Antipin, M.Yu.; Sharabarin, A.V.; Struchkov, Yu.T. Crystal structures of difluorochloronium hexafluoroniobate and hexafluorotantalate, ClF2NbF6 and ClF2TaF6. Zhurnal Neorganicheskoi Khimii, 1991, 36, 2266-2270 |
| 1536703 | CIF | Cl F8 Ta | P c c a | 10.049; 5.775; 10.67 90; 90; 90 | 619.212 | Ellern, A.M.; Antipin, M.Yu.; Sharabarin, A.V.; Struchkov, Yu.T. Crystal structures of difluorochloronium hexafluoroniobate and hexafluorotantalate, ClF2NbF6 and ClF2TaF6. Zhurnal Neorganicheskoi Khimii, 1991, 36, 2266-2270 |
| 1545669 | CIF | C33 H21 F6 N4 Ni P | P c c a | 21.052; 9.434; 29.833 90; 90; 90 | 5925 | Adinarayana, B.; Thomas, Ajesh P.; Satha, Pardhasaradhi; Srinivasan, A. Syntheses of Bipyricorroles and Their Meso‒Meso Coupled Dimers Organic Letters, 2017 |
| 1545671 | CIF | C33 H21 Cl0 F6 N4 P Pd | P c c a | 21.0949; 9.3501; 30.015 90; 90; 90 | 5920.1 | Adinarayana, B.; Thomas, Ajesh P.; Satha, Pardhasaradhi; Srinivasan, A. Syntheses of Bipyricorroles and Their Meso‒Meso Coupled Dimers Organic Letters, 2017 |
| 1546603 | CIF | C30 H22 Br2 O6 P2 | P c c a | 27.0189; 14.0226; 7.2637 90; 90; 90 | 2752.04 | Essid, I.; Laborde, C.; Legros, F.; Sevrain, N.; Touil, S.; Rolland, M.; Ayad, T.; Volle, J.-N.; Pirat, J.-L.; Virieux, D. Phosphorus-Containing Bis-allenes: Synthesis and Heterocyclization Reactions Mediated by Iodine or Copper Dibromide. Organic letters, 2017 |
| 1546865 | CIF | F8 Fe2 Li5 O4 P | P c c a | 18.835; 9.183; 9.479 90; 90; 90 | 1639.5 | Yaghoobnejad Asl, Hooman; Ghosh, Kartik; Choudhury, Amitava A highly fluorinated lithium iron phosphate with interpenetrating lattices: electrochemistry and ionic conductivity Dalton Transactions, 2017, 46, 12588-12596 |
| 1549467 | CIF | C2 H3 Na O2 | P c c a | 5.9482; 10.0866; 5.8984 90; 90; 90 | 353.89 | Birger Dittrich; Justin Bergmann; Peter Roloff; Guido J. Reiss New Polymorphs of the Phase-Change Material Sodium Acetate Crystals, 2018, 8, 213 |
| 1554145 | CIF | C28 H24 O8 S4 | P c c a | 28.9409; 9.0789; 21.712 90; 90; 90 | 5704.9 | Takeda, Takashi; Ozawa, Masataka; Akutagawa, Tomoyuki Dynamic Motion of Twisted π System-Induced Temperature-Dependent Dielectric Response in the Neat Liquid State The Journal of Physical Chemistry C, 2019, 123, 20152 |
| 1557745 | CIF | C9 H8 K N O3 | P c c a | 13.9484; 18.528; 7.0215 90; 90; 90 | 1814.6 | Bakalorz, Karolina; Przypis, Łukasz; Tomczyk, Mateusz Michał; Książek, Maria; Grzesik, Ryszard; Kuźnik, Nikodem Unprecedented Water Effect as a Key Element in Salicyl-Glycine Schiff Base Synthesis. Molecules (Basel, Switzerland), 2020, 25, 1257 |
| 1557908 | CIF | C38 H32 Cd N6 O6 S3 | P c c a | 19.0673; 26.1197; 15.5005 90; 90; 90 | 7719.7 | Doheny, Patrick W.; Clegg, Jack K.; Tuna, Floriana; Collison, David; Kepert, Cameron J.; D'Alessandro, Deanna M. Quantification of the mixed-valence and intervalence charge transfer properties of a cofacial metal‒organic framework via single crystal electronic absorption spectroscopy Chemical Science, 2020, 11, 5213-5220 |
| 1558412 | CIF | C8 H26 Cu F K N2 O9 | P c c a | 18.814; 9.623; 8.678 90; 90; 90 | 1571.1 | Kotila, Sirpa; Valkonen, Jussi Copper(II) Complexes of 2-Amino-2-hydroxymethyl-1,3-propanediol. Part 4. Synthesis, Structure and Thermal Behavior of trans-Bis[2-amino-2-hydroxymethyl-1,3-propanediolato-O,N]copper(II) Potassium Fluoride and Bromide, [Cu(C4H10NO3)2]KF.3H2O and [Cu(C4H10NO3)2]KBr.2H2O Acta Chemica Scandinavica, 1994, 48, 312-318 |
| 1558413 | CIF | C8 H24 Br Cu K N2 O8 | P c c a | 18.482; 9.805; 8.776 90; 90; 90 | 1590.4 | Kotila, Sirpa; Valkonen, Jussi Copper(II) Complexes of 2-Amino-2-hydroxymethyl-1,3-propanediol. Part 4. Synthesis, Structure and Thermal Behavior of trans-Bis[2-amino-2-hydroxymethyl-1,3-propanediolato-O,N]copper(II) Potassium Fluoride and Bromide, [Cu(C4H10NO3)2]KF.3H2O and [Cu(C4H10NO3)2]KBr.2H2O Acta Chemica Scandinavica, 1994, 48, 312-318 |
| 1560359 | CIF | C18 H17 Cl2 Mn N3 O6 | P c c a | 14.4985; 12.2421; 23.766 90; 90; 90 | 4218.3 | Ming, Mei; Bai, Na A rare 3D chloro-laced Mn(II) metal-organic framework to show sensitive probing effect to Hg 2+ Journal of Solid State Chemistry, 2017, 254, 9-13 |
| 1560360 | CIF | C20 H21 Mn N3 O5 | P c c a | 20.267; 13.5379; 7.4103 90; 90; 90 | 2033.2 | Ming, Mei; Bai, Na A rare 3D chloro-laced Mn(II) metal-organic framework to show sensitive probing effect to Hg 2+ Journal of Solid State Chemistry, 2017, 254, 9-13 |
| 1561167 | CIF | C2 H6 Mn O7 | P c c a | 9.7581; 6.61; 10.5127 90; 90; 90 | 678.08 | Puzan, Anna N.; Baumer, Vyacheslav N.; Lisovytskiy, Dmytro V.; Mateychenko, Pavel V. Structure disordering and thermal decomposition of manganese oxalate dihydrate, MnC2O4·2H2O Journal of Solid State Chemistry, 2018, 260, 87-94 |
| 1562087 | CIF | C28 H20 N8 Ni O5 | P c c a | 21.156; 8.726; 15.847 90; 90; 90 | 2925 | Liu, Yong-Liang; Wu, Ya-Pan; Li, Dong-Sheng; Dong, Wen-Wen; Zhou, Chun-Sheng Two interpenetrating CuII/NiII-coordinated polymers based on an unsymmetrical bifunctional N/O-tectonic: Syntheses, structures and magnetic properties Journal of Solid State Chemistry, 2015, 223, 38-43 |
| 1562849 | CIF | C9 H10 N10 O3 Zn2 | P c c a | 10.406; 13.102; 12.723 90; 90; 90 | 1734.6 | Liu, Dong-Sheng; Sui, Yan; Chen, Weng-Tong; Huang, Jian-Gen; Chen, Jian-Zhong; Huang, Chang-Cang Two new Zn(II) and Cd(II) coordinastion polymers based on amino-tetrazole and phenylcarboxylate: Syntheses, topological structures and photoluminescent properties Journal of Solid State Chemistry, 2012, 196, 161-167 |
| 1565396 | CIF | C25 H23 N4 O5 Zn | P c c a | 32.984; 11.556; 15.213 90; 90; 90 | 5798.6 | Dong, Mengwei; Lu, Lu; Tan, Xueyan; An, Baichao; Singh, Ayushi; Alowais, Ahmad; Alarifi, Abdullah; Kumar, Abhinav; Muddassir, Mohd. Syntheses and photocatalytic properties of two new d10- and d9-based 2D coordination polymers Inorganica Chimica Acta, 2020, 502, 119334 |
| 1569846 | CIF | C20 H44 B F4 P | P c c a | 23.535; 10.8949; 9.5632 90; 90; 90 | 2452.1 | Rauber, Daniel; Philippi, Frederik; Schroeder, Daniel; Morgenstern, Bernd; White, Andrew J. P.; Jochum, Marlon; Welton, Tom; Kay, Christopher W. M. Room temperature ionic liquids with two symmetric ions. Chemical science, 2023, 14, 10340-10346 |
| 1573909 | CIF | C62 H78 Au2 N4 O4 | P c c a | 36.539; 12.2149; 29.581 90; 90; 90 | 13202.6 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1574197 | CIF | C41 H65.5 Mo N O2 P2 S | P c c a | 31.877; 14.204; 18.861 90; 90; 90 | 8540 | Mandal, Souvik; Zhou, Xiaoguang; Bruch, Quinton; Allen, Rachel N.; Giordano, Laurence W.; Walker, Nicholas J. I.; Emge, Thomas J.; Hasanayn, Faraj; Miller, Alexander J. M.; Malakar, Santanu; Goldman, Alan S. Dinitrogen Reduction to Ammonia with a Pincer Mo Complex: New Insights into the Mechanism of Nitride-to-Ammonia Conversion Chemical Science, 2025 |
| 1574199 | CIF | C38 H63.5 Mo N5 O0.75 P2 S | P c c a | 31.9495; 14.14073; 18.9898 90; 90; 90 | 8579.39 | Mandal, Souvik; Zhou, Xiaoguang; Bruch, Quinton; Allen, Rachel N.; Giordano, Laurence W.; Walker, Nicholas J. I.; Emge, Thomas J.; Hasanayn, Faraj; Miller, Alexander J. M.; Malakar, Santanu; Goldman, Alan S. Dinitrogen Reduction to Ammonia with a Pincer Mo Complex: New Insights into the Mechanism of Nitride-to-Ammonia Conversion Chemical Science, 2025 |
| 2000110 | CIF | C4 H22 N4 O13 P4 | P c c a | 13.168; 8.599; 15.152 90; 90; 90 | 1715.69 | Averbuch-Pouchot, M. T.; Durif, A.; Guitel, J. C. Structure of bis(ethylenediammonium) cyclo-tetraphosphate monohydrate Acta Crystallographica, Section C: Crystal Structure Communications, 1989, 45, 428-430 |
| 2000121 | CIF | C12 H12 Co2 N4 O12 | P c c a | 8.037; 13.977; 15.478 90; 90; 90 | 1738.69 | Richard, P.; Qui, D. T.; Bertaut, E. F. Structure cristalline du polychélate Co-2,3-PYD.3H2O Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry, 1973, 29, 1111-1115 |
| 2000728 | CIF Paper | C22 H16 N3 S16 | P c c a | 14.744; 6.676; 32.151 90; 90; 90 | 3164.7 | Bu, X.; Coppens, P.; Lederle, B.; Naughton, M. J. Structure of (BEDT-TTF)~2~N(CN)~2~ Acta Crystallographica Section C, 1992, 48, 1560-1561 |
| 2002995 | CIF HKL Paper | C8 H18 Cd O11 | P c c a | 7.304; 9.981; 19.956 90; 90; 90 | 1454.8 | Michaelides, O. A.; Tsaousis, D.; Skoulika, S.; Raptopoulou, C. P.; Terzis, A. An Unusual Hydrogen-Bonded Network Associated with Metal-Organic Chains: Structure and Crystal Packing of the Coordination Polymer [Cd(terephthalate)(H~2~O)~3~].4H~2~O Acta Crystallographica Section B, 1998, 54, 657-662 |
| 2007896 | CIF HKL Paper | Na Ni O9 P3 | P c c a | 13.734; 10.543; 9.83 90; 90; 90 | 1423.4 | Erragh, Fatima; Boukhari, Ali; Sadel, Abderahim; Holt, Elizabeth M. Sodium Nickel Polyphosphate Acta Crystallographica Section C, 1998, 54, 1746-1747 |
| 2011160 | CIF HKL Paper | C9 H8 K N O3 | P c c a | 13.8864; 18.4943; 6.9664 90; 90; 90 | 1789.1 | Paredes-García, Verónica; Venegas-Yazigi, Diego; Lough, Alan J.; Latorre, Ramón Potassium <i>N</i>-(6-oxocyclohexa-1,3-dien-5-ylidenemethyl)glycinate Acta Crystallographica Section C, 2000, 56, e283-e283 |
| 2016959 | CIF HKL Paper | C22 H28 Cl4 Co N2 O11 | P c c a | 21.4257; 8.6567; 33.537 90; 90; 90 | 6220.3 | Fang, Yong-Qin; Lu, Ming; Lu, Chun-Xu Influence of solvent on the structures of two one-dimensional cobalt(II) coordination polymers with tetrachloroterephthalate Acta Crystallographica Section C, 2009, 65, m86-m90 |
| 2020464 | CIF HKL Paper | C40 H36 N2 O14 Zn2 | P c c a | 16.864; 11.067; 22.764 90; 90; 90 | 4248.5 | Liang, Feng-Lan; Ma, De-Yun; Qin, Liang A hydrostable and twofold interpenetrating three-dimensional zinc‒organic framework with rob topology based on 4,4'-oxydibenzoate and 3,3'-dimethyl-4,4'-bipyridine ligands Acta Crystallographica Section C, 2016, 72, 373-378 |
| 2106440 | CIF | H45 O61 P W12 | P c c a | 20.788; 13.086; 18.879 90; 90; 90 | 5135.69 | Spirlet, M.R.; Busing, W.R. Dodecatungstophosphoric acid-21-water by neutron diffraction Acta Crystallographica B (24,1968-38,1982), 1978, 34, 907-910 |
| 2200215 | CIF HKL Paper | C25 H18.8 Ag F3 N4 O4.4 S | P c c a | 15.3582; 11.6957; 14.8253 90; 90; 90 | 2663 | Vallina, Ana Tesouro; Stoeckli-Evans, Helen <i>catena</i>-Poly[[silver(I)-μ-{bis[4-(2-pyridylmethyleneamino)phenyl] ether}] trifluoromethanesulfonate 0.4-hydrate]: a zigzag coordination polymer Acta Crystallographica Section E, 2001, 57, m59-m61 |
| 2204102 | CIF HKL Paper | C20 H20 Cl2 Co N4 O4 | P c c a | 15.651; 7.597; 18.848 90; 90; 90 | 2241 | Gao, Shan; Zhang, Xian-Fa; Huo, Li-Hua; Lu, Zhen-Zhong; Zhao, Hui; Zhao, Jing-Gui Dichlorotetrakis(3-hydroxypyridine)cobalt(II) Acta Crystallographica Section E, 2004, 60, m1128-m1130 |
| 2204331 | CIF HKL Paper | C20 H20 Cl2 N4 Ni O4 | P c c a | 15.701; 7.611; 18.606 90; 90; 90 | 2223.4 | Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Lu, Zhen-Zhong; Zhao, Hui Dichlorotetrakis(3-hydroxypyridine-κ<i>N</i>)nickel(II) Acta Crystallographica Section E, 2004, 60, m1367-m1369 |
| 2205812 | CIF HKL Paper | C36 H24 F12 N12 P2 Ru | P c c a | 21.474; 11.008; 16.044 90; 90; 90 | 3793 | Hartshorn, Richard M.; Zibaseresht, Ramin; Robinson, Ward T. Bis[2,4-bis(2-pyridyl-κ<i>N</i>)-6-(4-pyridyl)-1,3,5-triazine-κ<i>N</i>^3^]ruthenium(II) bis(hexafluorophosphate) Acta Crystallographica Section E, 2005, 61, m981-m983 |
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