Crystallography Open Database
Search results
Result: there are 437 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 'New Journal of Chemistry' volume of publication is 34
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
---|---|---|---|---|---|---|
7053246 | CIF | C59 H79 O6 P | I 1 2/m 1 | 14.929; 21.378; 18.173 90; 108.889; 90 | 5487.6 | Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling New Journal of Chemistry, 2010, 34, 1478 |
7053247 | CIF | C56 H71 O5 P | P 1 21/n 1 | 10.28; 27.784; 17.984 90; 91.06; 90 | 5136 | Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling New Journal of Chemistry, 2010, 34, 1478 |
7053248 | CIF | C73 H96 O6 P2 | P -1 | 13.6778; 16.7394; 19.432 71.8; 78.874; 77.135 | 4083.7 | Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling New Journal of Chemistry, 2010, 34, 1478 |
7053249 | CIF | C49 H64 O6 | P 1 21/n 1 | 10.0674; 13.3559; 33.067 90; 98.054; 90 | 4402.3 | Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms New Journal of Chemistry, 2010, 34, 250 |
7053250 | CIF | C51 H72 O8 | P c a 21 | 23.887; 17.151; 12.429 90; 90; 90 | 5092 | Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms New Journal of Chemistry, 2010, 34, 250 |
7053251 | CIF | C55 H78 O8 | P c a 21 | 23.9696; 17.1752; 12.4147 90; 90; 90 | 5110.9 | Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms New Journal of Chemistry, 2010, 34, 250 |
7053252 | CIF | C58 H108 Cl4 N36 O38 | R -3 :H | 37.8856; 37.8856; 16.3396 90; 90; 120 | 20310.5 | Wu, Xiao-jun; Hu, Kai; Meng, Xiang-gao; Cheng, Gong-zhen A cucurbit[8]uril inclusion complex with 1,7-dimethyl-1,4,7,10-tetraazacyclododecane tetrachloride New Journal of Chemistry, 2010, 34, 17 |
7053253 | CIF | C32 H26 O4 | P -1 | 10.1926; 11.0478; 13.096 101.849; 102.082; 115.675 | 1224.1 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053254 | CIF | C52 H42 N4 O8 | P c a 21 | 20.631; 7.1465; 28.309 90; 90; 90 | 4173.9 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053255 | CIF | C48 H38 N4 O4 | P 1 21/c 1 | 14.472; 16.115; 8.057 90; 93.044; 90 | 1876.4 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053256 | CIF | C36 H38 O6 S2 | P 1 21/c 1 | 11.0387; 7.4017; 19.498 90; 96.343; 90 | 1583.3 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053257 | CIF | C40 H42 O8 | P -1 | 7.3791; 10.4359; 11.3692 93.357; 95.241; 100.824 | 853.77 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053258 | CIF | C44 H58 O8 | C 1 2/c 1 | 33.506; 5.8797; 22.036 90; 115.061; 90 | 3932.5 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053259 | CIF | C50 H38 N3 O4 | P -1 | 10.2976; 11.2084; 18.4225 96.041; 103.721; 102.7 | 1987.1 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053260 | CIF | C40 H34 N4 O8 | P 1 21/c 1 | 13.064; 7.6296; 16.929 90; 99.722; 90 | 1663.1 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053261 | CIF | C48 H58 O16 | P -1 | 9.039; 10.605; 13.461 101.94; 98.428; 112.198 | 1132.3 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053262 | CIF | C44 H54 O14 S2 | P 1 21/c 1 | 10.855; 14.204; 14.8984 90; 111.17; 90 | 2142.1 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053263 | CIF | C42 H48 N2 O6 | C 1 2/c 1 | 23.799; 8.0974; 18.3595 90; 113.226; 90 | 3251.3 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053264 | CIF | C38 H40 N2 O8 | P -1 | 5.5173; 12.0094; 12.9806 91.144; 96.446; 91.41 | 854.17 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053265 | CIF | C44 H54 O6 S2 | P 1 21/n 1 | 11.34; 8.2249; 21.892 90; 102.049; 90 | 1996.9 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053266 | CIF | C40 H42 O4 | P 1 21/c 1 | 15.009; 5.5072; 18.887 90; 104.85; 90 | 1509 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053267 | CIF | C47 H50 O4 | P -1 | 8.7313; 10.2761; 11.4745 64.982; 75.98; 86.58 | 904.07 | Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini Supramolecular networks of a H-shaped aromatic phenol host New Journal of Chemistry, 2010, 34, 623 |
7053268 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5591; 4.8698; 23.3593 90; 93.448; 90 | 631.23 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053269 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5751; 4.8787; 23.403 90; 93.223; 90 | 635.54 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053270 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5929; 4.8891; 23.4513 90; 92.978; 90 | 640.39 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053271 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6215; 4.8939; 23.492 90; 92.76; 90 | 645.54 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053272 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6218; 4.9063; 23.526 90; 92.48; 90 | 648.29 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053273 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6491; 4.9306; 23.6191 90; 92.277; 90 | 657.35 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053274 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.656; 22.329; 8.009 90; 99.76; 90 | 644.4 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053275 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.669; 22.3473; 8.012 90; 99.63; 90 | 647.7 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053276 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.686; 22.368; 8.015 90; 99.44; 90 | 651.9 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053277 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.545; 4.877; 23.3506 90; 93.62; 90 | 630.2 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053278 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.564; 4.879; 23.3903 90; 93.43; 90 | 633.8 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053279 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.597; 4.897; 23.47 90; 92.97; 90 | 642.4 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
7053280 | CIF | Ag2.001 As8 Fe3 Na4.999 O28 | C 1 2/c 1 | 9.9732; 8.5492; 28.664 90; 94.152; 90 | 2437.6 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
7053281 | CIF | Ag2 As8 Fe3 Na5 O28 | C 1 2/c 1 | 9.9512; 8.5741; 28.8231 90; 93.91; 90 | 2453.54 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
7053282 | CIF | Ag5 Fe3 Na2 O28 P8 | C 1 2/c 1 | 9.5375; 8.3886; 28.0971 90; 93.623; 90 | 2243.45 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
7053283 | CIF | Ag5 Fe3 Na2 O28 P8 | C 1 2/c 1 | 28.551; 8.3631; 30.064 90; 111.89; 90 | 6661 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
7053284 | CIF | C3 H3 N2 O3 Rb S | I 41/a :2 | 9.7332; 9.7332; 29.9414 90; 90; 90 | 2836.5 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
7053285 | CIF | C3 H3 Cs N2 O3 S | P 1 21/c 1 | 8.8211; 8.1086; 9.8888 90; 91.56; 90 | 707.05 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
7053286 | CIF | C6 H18 Mg N4 O12 S2 | P -1 | 7.0543; 7.7307; 8.6389 72.572; 74.37; 76.045 | 426.22 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
7053287 | CIF | C6 H6 N4 O6 S2 Sr | P -1 | 6.027; 7.243; 14.186 92.491; 101.383; 97.471 | 600.4 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
7053288 | CIF | C6 H18 Cu N4 O12 S2 | P 1 21/c 1 | 9.0315; 13.2968; 7.7103 90; 109.747; 90 | 871.48 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
7053289 | CIF | C3 H3 F3 O2 S2 | P -1 | 6.4698; 9.0499; 12.57 97.219; 93.131; 96.888 | 723.07 | Torrico-Vallejos, Sonia; Erben, Mauricio F.; Boese, Roland; Della Védova, Carlos O. Methoxycarbonyl trifluoromethyl disulfide, CH3OC(O)SSCF3: synthesis, structure and conformational properties New Journal of Chemistry, 2010, 34, 1365 |
7053290 | CIF | C19 H17 N O | P 1 21/c 1 | 9.3446; 10.612; 15.267 90; 107.7; 90 | 1442.3 | Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A. Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine New Journal of Chemistry, 2010, 34, 405 |
7053291 | CIF | C19 H18 Cl N O | P -1 | 6.3219; 8.4477; 15.349 102.22; 92.54; 106.21 | 764.6 | Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A. Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine New Journal of Chemistry, 2010, 34, 405 |
7053292 | CIF | C19 H18 N2 O4 | P -1 | 6.3168; 8.1971; 16.497 100.78; 91.2; 100.44 | 823.9 | Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A. Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine New Journal of Chemistry, 2010, 34, 405 |
7053293 | CIF | C19 H17 Cl5 N4 Zn | P -1 | 8.8197; 12.0309; 12.1267 98.231; 104.297; 104.816 | 1175.8 | Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A. The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host New Journal of Chemistry, 2010, 34, 52 |
7053294 | CIF | C18 H28 Cl2 N4 Zn | P 1 21/n 1 | 10.6333; 11.5074; 17.861 90; 97.665; 90 | 2166 | Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A. The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host New Journal of Chemistry, 2010, 34, 52 |
7053295 | CIF | C14 H12 Cl2 N4 S2 Zn | P 1 21/c 1 | 13.0349; 20.252; 14.7727 90; 113.506; 90 | 3576.1 | Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A. The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host New Journal of Chemistry, 2010, 34, 52 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!