Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7201199 | CIF | C28 H30 Cu F12 N4 O6 | P -1 | 10.387; 13.198; 14.134 100.262; 103.434; 103.705 | 1774.3 | Fedin, Matvey V.; Veber, Sergey L.; Romanenko, Galina V.; Ovcharenko, Victor I.; Sagdeev, Renad Z.; Klihm, Gudrun; Reijerse, Edward; Lubitz, Wolfgang; Bagryanskaya, Elena G. Dynamic mixing processes in spin triads of “breathing crystals” Cu(hfac)2LR: a multifrequency EPR study at 34, 122 and 244 GHz Physical Chemistry Chemical Physics, 2009, 11, 6654-6663 |
| 7201300 | CIF | C8 H16 Au2 N8 Zn | C 1 2/m 1 | 10.516; 13.2522; 6.4403 90; 119.508; 90 | 781.1 | Aguiar, Pedro M.; Katz, Michael J.; Leznoff, Daniel B.; Kroeker, Scott Natural abundance 13C and 15N solid-state NMR analysis of paramagnetic transition-metal cyanide coordination polymers Physical Chemistry Chemical Physics, 2009, 11, 6925-6934 |
| 7201928 | CIF | C28 H23 F | C 1 2/c 1 | 10.1807; 12.6858; 17.0404 90; 106.996; 90 | 2104.7 | Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S. Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations Physical Chemistry Chemical Physics, 2008, 10, 2686-2694 |
| 7201929 | CIF | C28 H24 | P 1 21/n 1 | 8.27; 18.901; 13.723 90; 103.554; 90 | 2085.3 | Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S. Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations Physical Chemistry Chemical Physics, 2008, 10, 2686-2694 |
| 7201930 | CIF | C28 H23 Cl | P b c a | 8.084; 15.976; 32.417 90; 90; 90 | 4187 | Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S. Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations Physical Chemistry Chemical Physics, 2008, 10, 2686-2694 |
| 7201931 | CIF | C29 H23 N | P 1 21/c 1 | 8.3064; 32.077; 8.3998 90; 108.092; 90 | 2127.4 | Cozzi, Franco; Annunziata, Rita; Benaglia, Maurizio; Baldridge, Kim K.; Aguirre, Gerardo; Estrada, Jesús; Sritana-Anant, Yongsak; Siegel, Jay S. Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations Physical Chemistry Chemical Physics, 2008, 10, 2686-2694 |
| 7201997 | CIF | C46 H56 O8 | P 4/n :2 | 12.7212; 12.7212; 12.5853 90; 90; 90 | 2036.67 | Udachin, Konstantin A.; Moudrakovski, Igor L.; Enright, Gary D.; Ratcliffe, Christopher I.; Ripmeester, John A. Loading-dependent structures of CO2 in the flexible molecular van der Waals host p-tert-butylcalix[4]arene with 1 : 1 and 2 : 1 guest‒host stoichiometries Physical Chemistry Chemical Physics, 2008, 10, 4636-4643 |
| 7201998 | CIF | C45 H56 O6 | P 1 21/n 1 | 12.5069; 25.538; 12.5939 90; 90.013; 90 | 4022.5 | Udachin, Konstantin A.; Moudrakovski, Igor L.; Enright, Gary D.; Ratcliffe, Christopher I.; Ripmeester, John A. Loading-dependent structures of CO2 in the flexible molecular van der Waals host p-tert-butylcalix[4]arene with 1 : 1 and 2 : 1 guest‒host stoichiometries Physical Chemistry Chemical Physics, 2008, 10, 4636-4643 |
| 7202061 | CIF | C115.76 H152.28 N O18.88 | P 4/n n c :2 | 15.5514; 15.5514; 22.5951 90; 90; 90 | 5464.5 | Polovyanenko, Dmitriy N.; Bagryanskaya, Elena G.; Schnegg, Alexander; Möbius, Klaus; Coleman, Anthony W.; Ananchenko, Gennady S.; Udachin, Konstantin A.; Ripmeester, John A. Inclusion of 4-methoxy-2,2,6,6-tetramethylpiperidine-N-oxyl in a calixarene nanocapsule in the solid state Physical Chemistry Chemical Physics, 2008, 10, 5299-5307 |
| 7202076 | CIF | C31 H41 F6 P4 Rh | P 1 21/n 1 | 13.0859; 17.6276; 14.3952 90; 93.396; 90 | 3314.8 | Bernard, Guy M.; Feindel, Kirk W.; Wasylishen, Roderick E.; Cameron, T. Stanley Solid-state phosphorus-31 NMR spectroscopy of a multiple-spin system: an investigation of a rhodium‒triphosphine complex Physical Chemistry Chemical Physics, 2008, 10, 5552-5563 |
| 7202108 | CIF | C H9 N9 O4 | P b c a | 12.5217; 8.1036; 16.9859 90; 90; 90 | 1723.57 | Klapötke, Thomas M.; Stierstorfer, Jörg Triaminoguanidinium dinitramide—calculations, synthesis and characterization of a promising energetic compound Physical Chemistry Chemical Physics, 2008, 10, 4340-4346 |
| 7202463 | CIF | C6 H14 N4 S2 | P -1 | 6.6966; 9.2281; 9.6691 68.627; 81.3; 75.717 | 537.98 | Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules? Physical Chemistry Chemical Physics, 2008, 10, 3569-3577 |
| 7202464 | CIF | C4 H10 N4 S2 | P 1 21/c 1 | 7.1297; 7.7609; 16.002 90; 101.346; 90 | 868.13 | Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules? Physical Chemistry Chemical Physics, 2008, 10, 3569-3577 |
| 7202465 | CIF | C10 H22 N4 S2 | P 1 21/n 1 | 9.0787; 7.8491; 10.5697 90; 98.575; 90 | 744.77 | Wolstenholme, David J.; Weigand, Jan J.; M. Cameron, Elinor; Cameron, T. Stanley The progression of strong and weak hydrogen bonds in a series of ethylenediammonium dithiocyanate derivatives—a new bonding protocol for macromolecules? Physical Chemistry Chemical Physics, 2008, 10, 3569-3577 |
| 7203848 | CIF | C28 H60 Cl3 Gd N8 O20 | P 4 21 2 | 15.501; 15.497; 10.428 89.99; 90.02; 90 | 2505 | Umebayashi, Yasuhiro; Matsumoto, Kai; Mekata, Isamu; Ishiguro, Shin-ichi Solvation structure of lanthanide(iii) ions in solvent mixtures of N,N-dimethylformamide and N,N-dimethylacetamide studied by titration Raman spectroscopy Physical Chemistry Chemical Physics, 2002, 4, 5599-5605 |
| 7203849 | CIF | C19 H21 I N2 O S | P -1 | 7.5429; 10.9459; 12.1974 76.36; 78.1; 74.491 | 931.94 | Tang, Xin-Jing; Wu, Li-Zhu; Zhang, Li-Ping; Tung, Chen-Ho Two-photon-pumped frequency-upconverted lasing and optical power limiting properties of vinylbenzothiazole-containing compounds in solution Physical Chemistry Chemical Physics, 2002, 4, 5744-5747 |
| 7203851 | CIF | C20 H30 Au2 S6 W2 | P 1 21/a 1 | 17.123; 9.373; 18.019 90; 107.43; 90 | 2759.2 | Lang, Jian-Ping; Yu, Hong; Ji, Shun-Jun; Sun, Zhen-Rong Synthesis, crystal structure and third-order nonlinear optical (NLO) properties of a novel tetranuclear organometallic cluster [(?5?C5Me5)WS3Au]2 Physical Chemistry Chemical Physics, 2003, 5, 5127 |
| 7203914 | CIF | C11.56 H26.43 Al7.35 Co1.65 N1.65 O37.05 P9 | R -3 c :H | 13.192; 13.192; 46.149 90; 90; 120 | 6955 | Barrett, P. A.; Jones, R. H. Evidence for ordering of cobalt ions in the microporous solid acid catalyst CoDAF-4 by single crystal X-ray diffraction and resonant X-ray powder diffraction Physical Chemistry Chemical Physics, 2000, 2, 407 |
| 7203981 | CIF | C10 H25 N3 O7 S | P 1 21/c 1 | 13.503; 8.435; 14.839 90; 112.24; 90 | 1564.4 | Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew Crystal structure and vibrational spectra of bis(betaine) sulfamate Physical Chemistry Chemical Physics, 2000, 2, 3503 |
| 7203982 | CIF | C10 H25 N3 O7 S | P 1 21/c 1 | 13.467; 8.353; 14.701 90; 112; 90 | 1533.3 | Ilczyszyn, Maria M.; Wierzejewska, Maria; Ciunik, Zbigniew Crystal structure and vibrational spectra of bis(betaine) sulfamate Physical Chemistry Chemical Physics, 2000, 2, 3503 |
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