Crystallography Open Database
Search results
Result: there are 210 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 'Polyhedron'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1512914 | CIF | C84.5 H170 O24 Zr5 | P -1 | 15.051; 15.642; 25.761 95.09; 93.18; 117.329 | 5335 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized carboxylic acid modified zirconium alkoxides for the production of zirconium oxide thin films Polyhedron, 2005, 24, 1727-1738 |
| 1512915 | CIF | C24 H20 F6 Mg N4 O4 | P -1 | 9.085; 16.764; 18.141 70.307; 85.569; 89.84 | 2592.7 | Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives Polyhedron, 2007, 26, 5095-5103 |
| 1512916 | CIF | C24 H32 Ca2 F12 O12 | P 1 21/c 1 | 10.0952; 20.8523; 17.1268 90; 90.58; 90 | 3605.1 | Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives Polyhedron, 2007, 26, 5095-5103 |
| 1512917 | CIF | C16 H11 F9 N2 O6 Sr | P n a 21 | 18.967; 14.068; 8.31 90; 90; 90 | 2217 | Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives Polyhedron, 2007, 26, 5095-5103 |
| 1512918 | CIF | C16 H11 Ba F9 N2 O6 | P 1 21/c 1 | 13.177; 19.169; 8.5978 90; 102.418; 90 | 2120.9 | Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives Polyhedron, 2007, 26, 5095-5103 |
| 1512919 | CIF | C16 H22 N2 O4 S2 Ti | C 1 2/c 1 | 11.07; 15.828; 10.706 90; 95.333; 90 | 1868 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized group 4 metal alkoxides modified with the pyridyl-based ligands 2-mercapto pyridine n-oxide and 3,3'-dihydroxy-2,2'-bipyridine Polyhedron, 2008, 27, 3079-3084 |
| 1512920 | CIF | C20 H30 N2 O4 S2 Ti | P -1 | 9.8761; 10.5179; 12.7351 95.878; 104.109; 105.309 | 1217.6 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized group 4 metal alkoxides modified with the pyridyl-based ligands 2-mercapto pyridine n-oxide and 3,3'-dihydroxy-2,2'-bipyridine Polyhedron, 2008, 27, 3079-3084 |
| 1512921 | CIF | C18 H26 N2 O4 S2 Ti | C 1 2/c 1 | 13.319; 14.978; 10.685 90; 95.781; 90 | 2120.7 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized group 4 metal alkoxides modified with the pyridyl-based ligands 2-mercapto pyridine n-oxide and 3,3'-dihydroxy-2,2'-bipyridine Polyhedron, 2008, 27, 3079-3084 |
| 1512922 | CIF | C60 H84 N6 O12 Ti3 | P -1 | 11.241; 18.098; 21.567 86.3; 89.248; 75.033 | 4230 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized group 4 metal alkoxides modified with the pyridyl-based ligands 2-mercapto pyridine n-oxide and 3,3'-dihydroxy-2,2'-bipyridine Polyhedron, 2008, 27, 3079-3084 |
| 1512923 | CIF | C54 H72 N6 O12 Zr3 | P 21 21 21 | 15.8; 16.544; 27.596 90; 90; 90 | 7213.5 | Timothy J. Boyle; Leigh Anna M. Ottley; Mark A. Rodriguez Structurally characterized group 4 metal alkoxides modified with the pyridyl-based ligands 2-mercapto pyridine n-oxide and 3,3'-dihydroxy-2,2'-bipyridine Polyhedron, 2008, 27, 3079-3084 |
| 1512924 | CIF | C2 H22 Br3 La O9 | P b c a | 12.654; 12.9686; 19.864 90; 90; 90 | 3259.8 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512925 | CIF | C6 H24 Br2 Ca O6 | P -3 | 8.386; 8.386; 6.8655 90; 90; 120 | 418.13 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512926 | CIF | C5 H20 Br3 La O5 | P 1 c 1 | 10.1803; 14.794; 10.6387 90; 106.532; 90 | 1536 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512927 | CIF | C5 H15 Br3 La O5 | P n a 21 | 12.3556; 9.9655; 12.5633 90; 90; 90 | 1546.9 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512928 | CIF | C8 H32 Cl6 La2 O8 | P 1 21/c 1 | 8.75; 18.635; 8.278 90; 108.958; 90 | 1276.6 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512929 | CIF | C10 H40 I3 La O10 | P 1 21/c 1 | 15.941; 8.5737; 20.14 90; 93.625; 90 | 2747.1 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512930 | CIF | C12 H24 Br3 O3 Sc | P b c n | 8.783; 13.884; 14.54 90; 90; 90 | 1773.1 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512931 | CIF | C16 H32 Br3 Nd O4 | P -1 | 8.2662; 9.3601; 15.485 79.185; 87.106; 74.956 | 1136.5 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512932 | CIF | C20 H20 Br3 N4 Nd | P b c a | 16.998; 17.515; 32.617 90; 90; 90 | 9711 | Timothy J. Boyle; Leigh Anna M. Ottley; Todd M. Alam; Mark A. Rodriguez; Pin Yang; Sarah K. Mcintyre Structural characterization of methanol substituted lanthanum halides Polyhedron, 2010, 29, 1784-1795 |
| 1512946 | CIF | C42 H74 Cl2 N2 Ni2 S15 | P 1 21/n 1 | 17.7947; 14.4615; 23.7863 90; 102.38; 90 | 5978.8 | Jonathan G. Breitzer; Thomas B. Rauchfuss Studies on α-C~3~S~5~^2-^ (dmit^2^) and its dinuclear Ni(II) complex: spectroscopic and structural characterization Polyhedron, 2000, 19, 1283-1291 |
| 1512978 | CIF | C19 H21 N3 O4 | P 1 21/c 1 | 13.9443; 6.895; 19.39 90; 109.953; 90 | 1752.4 | P. Mosae Selvakumar; E. Suresh; P.S. Subramanian Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association Polyhedron, 2007, 26, 749-756 |
| 1512979 | CIF | C18 H15 Cl2 N3 O2 | P 1 21/n 1 | 7.0141; 8.0449; 30.487 90; 90.972; 90 | 1720.1 | P. Mosae Selvakumar; E. Suresh; P.S. Subramanian Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association Polyhedron, 2007, 26, 749-756 |
| 1512980 | CIF | C36 H32 Cu N6 O6 | P -1 | 10.2073; 12.1721; 13.776 74.189; 74.273; 80.569 | 1577.7 | P. Mosae Selvakumar; E. Suresh; P.S. Subramanian Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association Polyhedron, 2007, 26, 749-756 |
| 1512981 | CIF | C18 H14 Cl2 Cu0.5 N3 O2 | C 1 2/c 1 | 23.197; 6.7034; 22.443 90; 90.918; 90 | 3489.4 | P. Mosae Selvakumar; E. Suresh; P.S. Subramanian Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association Polyhedron, 2007, 26, 749-756 |
| 1512982 | CIF | C13 H15 Cu N3 O6 S | P -1 | 7.0926; 9.5222; 11.4002 80.361; 81.178; 85.604 | 749.06 | Amal Cherian Kathalikkattil; Kamal Kumar Bisht; P.S. Subramanian; Eringathodi Suresh Synthesis, characterization and X-ray crystallographic investigation of 2-D hybrid hydrogen bonded and rectangular grid networks in Cu(II) and Co(II) metal complexes Polyhedron, 2010, 29, 1801-1809 |
| 1512983 | CIF | C13 H15 Co N3 O7 S | P 1 21/c 1 | 11.53; 13.921; 10.17 90; 95.452; 90 | 1625 | Amal Cherian Kathalikkattil; Kamal Kumar Bisht; P.S. Subramanian; Eringathodi Suresh Synthesis, characterization and X-ray crystallographic investigation of 2-D hybrid hydrogen bonded and rectangular grid networks in Cu(II) and Co(II) metal complexes Polyhedron, 2010, 29, 1801-1809 |
| 1513033 | CIF | C12 H10 Ag N3 O5 | C 1 2 1 | 22.541; 7.805; 3.786 90; 92.533; 90 | 665.4 | Ivanova, Bojidarka; Spiteller, Michael Ag^I^ and Zn^II^ complexes with possible application as NLO materials ‒ Crystal structures and properties Polyhedron, 2011, 30, 241-245 |
| 1513034 | CIF | C12 H10 Cl2 N2 O2 Zn | P n m a | 5.8478; 19.156; 12.328 90; 90; 90 | 1381 | Ivanova, Bojidarka; Spiteller, Michael Ag^I^ and Zn^II^ complexes with possible application as NLO materials ‒ Crystal structures and properties Polyhedron, 2011, 30, 241-245 |
| 1513035 | CIF | C10 H16 Cl4 N10 O4 Zn | P 1 21/c 1 | 12.817; 19.633; 8.0457 90; 95.544; 90 | 2015.1 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513036 | CIF | C15 H13 Cl4 N3 Zn | I m m 2 | 7.024; 13.676; 9.398 90; 90; 90 | 902.8 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513037 | CIF | C12 H24 Cl2 N2 O4 | P 1 21/c 1 | 7.044; 11.936; 9.775 90; 109.3; 90 | 775.7 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513038 | CIF | C32 H75 Cl16 N8 O8 Zn4 | P c a 21 | 22.703; 6.9191; 18.637 90; 90; 90 | 2927.6 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513039 | CIF | C12 H24 Cl4 N2 O3 Zn | P -1 | 8.376; 8.495; 13.243 99.284; 90.049; 97.645 | 921.4 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513040 | CIF | C18 H16 Cl4 N2 O2 Zn | C 1 2/c 1 | 15.177; 8.099; 16.636 90; 91.48; 90 | 2044 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1513041 | CIF | C6 H15 Cl4 N2 O Zn | P 1 21/c 1 | 6.6353; 13.732; 14.173 90; 91; 90 | 1291.2 | Lamshöft, Marc; Storp, Jürgen; Ivanova, Bojidarka; Spiteller, Michael Gas-phase CT-stabilized Ag(I) and Zn(II) metal-organic complexesexperimental vs. theoretical study Polyhedron, 2011, 30, 2564 |
| 1523956 | CIF | Ba6 Cu1.328 O49 Ti16.176 | C 1 2/m 1 | 19.865; 11.469; 9.94 90; 109.02; 90 | 2141.01 | Adams, R.D.; Layland, R.C. A barium coppper titanate. The synthesis and structural characterization of Ba8 Cu2 Ti22 O54 Polyhedron, 1997, 16, 2105-2108 |
| 1528399 | CIF | C10 H18 Cu2 N2 O10 | P -1 | 6.488; 7.3551; 9.8309 100.25; 99.212; 110.53 | 419.534 | Cejudo, R.; Alzuet, G.; Liu-Gonzalez, M.; Borras, J.; Sanz-Ruiz, F. Crystal structure, magnetic and spectroscopic properties of copper(II) formato dimethylformamide: a new tetracarboxylato-bridged copper(II) dimer Polyhedron, 2002, 21, 1057-1061 |
| 1528411 | CIF | C3 H9 Cl3 Ga O P | C 1 c 1 | 8.144; 10.216; 12.418 90; 105.577; 90 | 995.219 | Cheng Fei; Codgbrook, H.L.; Zhang Wenjian; Hector, A.L.; Reid, G.; Webster, M.; Levason, W. Gallium(III) halide complexes with phosphines, arsines and phosphine oxides - a comparative study Polyhedron, 2007, 26, 4147-4155 |
| 1528412 | CIF | C6 H18 Ga2 I6 O2 P2 | P 43 21 2 | 12.259; 12.259; 32.976 90; 90; 90 | 4955.73 | Cheng Fei; Codgbrook, H.L.; Webster, M.; Hector, A.L.; Reid, G.; Levason, W.; Zhang Wenjian Gallium(III) halide complexes with phosphines, arsines and phosphine oxides - a comparative study Polyhedron, 2007, 26, 4147-4155 |
| 1528665 | CIF | Cl6 H10 O5 Pb2 Sr | I 1 2/a 1 | 9.071; 11.813; 13.659 90; 101.41; 90 | 1434.71 | Abraham, I.; Benoit, D.M.; Demetriou, D.Z.; Mustarde, K.; Vordemvenne, E. Lone pair effects in trihalo-stannate and -plumbate anions in the crystal structures of Sr(MX3)(2) center dot 5H(2)O(M = Sn, X = Cl, Br; M = Pb, X = Br) Polyhedron, 2006, 25, 996-1002 |
| 1528743 | CIF | C32 H88 Mg4 O4 Si8 | P -1 | 10.7614; 21.68; 24.724 100.854; 89.542; 96.211 | 5631.39 | Moreno, C.A.; Bochmann, M.; Hughes, D.L. Synthesis and molecular structure of [Mg (C H2 Si Me3) (mu3-O C H2 Si Me3)]4 Polyhedron, 2007, 26, 2523-2526 |
| 1528891 | CIF | C4 H6 O4 Sn | I b a 2 | 13.9859; 21.187; 4.54 90; 90; 90 | 1345.29 | Stafeeva, V.S.; Mitiaev, A.S.; Abakumov, A.M.; Antipov, E.V.; Makarevich, A.M.; Tsirlin, A.A. Crystal structure and chemical bonding in tin(II) acetate Polyhedron, 2007, 26, 5365-5369 |
| 1528945 | CIF | C32 H16 Cl16 F32 Mn12 O52 | I -4 | 18.6838; 18.6838; 13.3829 90; 90; 90 | 4671.76 | Tsai Huilieu; Shiao Hongann; Lee Genehsiang; Wur Chingshuei; Jwo Tunyih; Yang Cheni Single-molecule magnets: [Mn12 O12 (O2 C C F2 Cl)16 (H2 O)4](0/-) Polyhedron, 2005, 24, 2205-2214 |
| 1529001 | CIF | C8 Mn3 Mo2 N10 O9 | C 1 2/c 1 | 28.666; 7.225; 7.776 90; 105.41; 90 | 1552.6 | Willemin, S.; Le Goff, X.F.; Larionova, J.; Bolvin, H.; Donnadieu, B.; Ruiz, E.; Guerin, C.; Henner, B. Cation templation of Mn(2+)/[Mo (C N)7](4-) system: formation of pseudo-dimorphs (N H4)2 Mn3 (H2 O)4 [Mo (C N)7]2 . nH2 O (n = 4,5) Polyhedron, 2005, 24, 1033-1046 |
| 1529226 | CIF HKL | C8 H26 N4 Ni O14 S2 | P -1 | 7.389; 7.631; 10.082 101.278; 96.786; 108.066 | 520.2 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor; Sidorenko, Maxim; Dmitrushkov, Michael Crystal structure and properties of the precursor [Ni(H2O)6](HTBA)2.2H2O and the complexes M(HTBA)2(H2O)2 (M=Ni, Co, Fe) Polyhedron, 2014, 70, 71 |
| 1529227 | CIF HKL | C8 H10 N4 Ni O6 S2 | P -1 | 6.88172; 7.0516; 7.19068 91.0836; 103.514; 113.128 | 309.61 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor; Sidorenko, Maxim; Dmitrushkov, Michael Crystal structure and properties of the precursor [Ni(H2O)6](HTBA)2.2H2O and the complexes M(HTBA)2(H2O)2 (M=Ni, Co, Fe) Polyhedron, 2014, 70, 71 |
| 1529228 | CIF HKL | C8 H10 Co N4 O6 S2 | P -1 | 6.89222; 7.03836; 7.25361 91.4988; 102.659; 113.512 | 312.27 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor; Sidorenko, Maxim; Dmitrushkov, Michael Crystal structure and properties of the precursor [Ni(H2O)6](HTBA)2.2H2O and the complexes M(HTBA)2(H2O)2 (M=Ni, Co, Fe) Polyhedron, 2014, 70, 71 |
| 1529229 | CIF HKL | C8 H10 Fe N4 O6 S2 | P -1 | 6.87606; 7.08625; 7.27721 91.1743; 102.687; 113.471 | 314.99 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor; Sidorenko, Maxim; Dmitrushkov, Michael Crystal structure and properties of the precursor [Ni(H2O)6](HTBA)2.2H2O and the complexes M(HTBA)2(H2O)2 (M=Ni, Co, Fe) Polyhedron, 2014, 70, 71 |
| 1529231 | CIF HKL | C8 H11 K N2 O2 S | P 21 21 21 | 4.2541; 14.739; 16.635 90; 90; 90 | 1043 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Sterkhova, Irina; Atuchin, Victor The cis-trans isomer transformation, spectroscopic and thermal properties of Li, Na, K 1,3-diethyl-2-thiobarbiturate complexes Polyhedron, 2015, 85, 493 |
| 1529232 | CIF HKL | C8 H11 N2 Na O2 S | P 1 21/n 1 | 10.5339; 7.6036; 14.186 90; 108.964; 90 | 1074.6 | Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Sterkhova, Irina; Atuchin, Victor The cis-trans isomer transformation, spectroscopic and thermal properties of Li, Na, K 1,3-diethyl-2-thiobarbiturate complexes Polyhedron, 2015, 85, 493 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!