Crystallography Open Database
Search results
Result: there are 226 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 'Acta Crystallographica, Section B' volume of publication is 49
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2100990 | CIF Paper | C4 H12 Br3 Cd N | P 61 | 9.219; 9.219; 20.86 90; 90; 120 | 1535.4 | Aguirre-Zamalloa, G.; Madariaga, G.; Couzi, M.; Breczewski, T. X-ray diffraction study of the ferroelectric phase transition of (CH~3~)~4~NCdBr~3~ (TMCB) Acta Crystallographica Section B, 1993, 49, 691-698 |
| 2100991 | CIF Paper | C4 H12 Br3 Cd N | P 63/m | 9.388; 9.388; 6.991 90; 90; 120 | 533.6 | Aguirre-Zamalloa, G.; Madariaga, G.; Couzi, M.; Breczewski, T. X-ray diffraction study of the ferroelectric phase transition of (CH~3~)~4~NCdBr~3~ (TMCB) Acta Crystallographica Section B, 1993, 49, 691-698 |
| 2100992 | CIF Paper | C Ca O3 | R -3 c :H | 4.991; 4.991; 17.062 90; 90; 120 | 368.1 | Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R. X-ray study of the electron density in calcite, CaCo~3~ Acta Crystallographica Section B, 1993, 49, 636-641 |
| 2100993 | CIF Paper | C11 H12 Cl2 | P -1 | 6.729; 9.176; 9.49 94.49; 107.42; 103.12 | 537.7 | Lukin, K. A.; Kozhushkov, S. I.; Zefirov, N. S.; Yufit, D. S.; Struchkov, Y. T. Geometry of three-membered rings in triangulanes: an X-ray structural study and additivity scheme for carbon–carbon bond lengths in triangulanes Acta Crystallographica Section B, 1993, 49, 704-708 |
| 2100994 | CIF Paper | C13 H14 Br2 | P -1 | 7.433; 9.508; 10.12 111.69; 93.81; 100.23 | 647.1 | Lukin, K. A.; Kozhushkov, S. I.; Zefirov, N. S.; Yufit, D. S.; Struchkov, Y. T. Geometry of three-membered rings in triangulanes: an X-ray structural study and additivity scheme for carbon–carbon bond lengths in triangulanes Acta Crystallographica Section B, 1993, 49, 704-708 |
| 2100995 | CIF Paper | C50 H39 Ir N3 O P2 | P -1 | 11.549; 12.528; 16.931 91.13; 99.45; 114.87 | 2181.5 | Wang, J.-C.; Shih, L. J.; Chen, Y.-J.; Wang, Y.; Fronczek, F. R.; Watkins, S. F. Structure of <i>trans</i>-<i>M</i>(CO)(C~4~N~3~)(PPh~3~)~2~.1.5C~6~H~6~ (<i>M</i> = Ir and Rh): the pyramidal geometry of the tricyanomethanide anion (C~4~N~3~^{-^}) Acta Crystallographica Section B, 1993, 49, 680-685 |
| 2100996 | CIF Paper | C50 H39 Ir N3 O P2 | P -1 | 11.33; 12.337; 16.908 91.61; 99.6; 114.48 | 2108.3 | Wang, J.-C.; Shih, L. J.; Chen, Y.-J.; Wang, Y.; Fronczek, F. R.; Watkins, S. F. Structure of <i>trans</i>-<i>M</i>(CO)(C~4~N~3~)(PPh~3~)~2~.1.5C~6~H~6~ (<i>M</i> = Ir and Rh): the pyramidal geometry of the tricyanomethanide anion (C~4~N~3~^{-^}) Acta Crystallographica Section B, 1993, 49, 680-685 |
| 2100997 | CIF Paper | C50 H39 N3 O P2 Rh | P -1 | 11.759; 11.779; 16.352 102.21; 104.61; 94.92 | 2118.8 | Wang, J.-C.; Shih, L. J.; Chen, Y.-J.; Wang, Y.; Fronczek, F. R.; Watkins, S. F. Structure of <i>trans</i>-<i>M</i>(CO)(C~4~N~3~)(PPh~3~)~2~.1.5C~6~H~6~ (<i>M</i> = Ir and Rh): the pyramidal geometry of the tricyanomethanide anion (C~4~N~3~^{-^}) Acta Crystallographica Section B, 1993, 49, 680-685 |
| 2100998 | CIF Paper | C9 H12 N2 O5 S | P 21 21 21 | 6.733; 6.831; 24.486 90; 90; 90 | 1126.2 | Li, H.; Kennedy, S. D.; Goldstein, B. M. Solid-state and solution conformations of isotiazofurin: crystallographic, computational and ^1^H NMR studies Acta Crystallographica Section B, 1993, 49, 729-738 |
| 2100999 | CIF Paper | C12 H24 S4 | P b c 21 | 17.7366; 9.8219; 9.0558 90; 90; 90 | 1577.6 | Blake, A. J.; Gould, R. O.; Halcrow, M. A.; Schröder, M. Conformational studies on [16]aneS~4~. Structures of α- and β-[16]aneS~4~ ([16]aneS~4~ = 1,5,9,13-tetrathiacyclohexadecane) Acta Crystallographica Section B, 1993, 49, 773-779 |
| 2101000 | CIF Paper | C12 H24 S4 | P 1 21 1 | 5.5605; 8.124; 17.662 90; 96.108; 90 | 793.3 | Blake, A. J.; Gould, R. O.; Halcrow, M. A.; Schröder, M. Conformational studies on [16]aneS~4~. Structures of α- and β-[16]aneS~4~ ([16]aneS~4~ = 1,5,9,13-tetrathiacyclohexadecane) Acta Crystallographica Section B, 1993, 49, 773-779 |
| 2101001 | CIF Paper | C21 H15 N3 O2 | P 1 21 1 | 12.1646; 5.5988; 12.389 90; 90.47; 90 | 843.75 | Duke, N. E. C.; Codding, P. W. Structural and molecular modeling studies of quinazolinone anticonvulsants Acta Crystallographica Section B, 1993, 49, 719-726 |
| 2101002 | CIF Paper | C21 H14 Cl N3 O2 | P 1 21/a 1 | 10.9354; 14.502; 13.019 90; 114.481; 90 | 1879 | Duke, N. E. C.; Codding, P. W. Structural and molecular modeling studies of quinazolinone anticonvulsants Acta Crystallographica Section B, 1993, 49, 719-726 |
| 2101003 | CIF Paper | C22 H17 N3 O2 | P 1 21/c 1 | 5.618; 30.329; 10.456 90; 98.21; 90 | 1763.3 | Duke, N. E. C.; Codding, P. W. Structural and molecular modeling studies of quinazolinone anticonvulsants Acta Crystallographica Section B, 1993, 49, 719-726 |
| 2101004 | CIF Paper | C21 H14 Cl N3 O2 | P b c a | 13.9347; 9.6794; 25.962 90; 90; 90 | 3501.7 | Duke, N. E. C.; Codding, P. W. Structural and molecular modeling studies of quinazolinone anticonvulsants Acta Crystallographica Section B, 1993, 49, 719-726 |
| 2101005 | CIF Paper | C23 H18 N2 O2 | P b c a | 10.2078; 10.237; 35.676 90; 90; 90 | 3728 | Duke, N. E. C.; Codding, P. W. Structural and molecular modeling studies of quinazolinone anticonvulsants Acta Crystallographica Section B, 1993, 49, 719-726 |
| 2101006 | CIF Paper | C26 H20 O4 | P -1 | 10.713; 11.991; 8.177 95.71; 105.14; 79.61 | 995.81 | Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J. Crystal structure correlations in the photochemistry of dimethyl 9-phenyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate Acta Crystallographica Section B, 1993, 49, 754-760 |
| 2101007 | CIF Paper | C26 H20 O4 | P 1 21/n 1 | 10.206; 16.485; 11.758 90; 95.48; 90 | 1969.2 | Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J. Crystal structure correlations in the photochemistry of dimethyl 9-phenyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate Acta Crystallographica Section B, 1993, 49, 754-760 |
| 2101008 | CIF Paper | C26 H20 O4 | P -1 | 11.074; 25.298; 7.668 94.22; 94.53; 101.77 | 2087.6 | Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J. Crystal structure correlations in the photochemistry of dimethyl 9-phenyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate Acta Crystallographica Section B, 1993, 49, 754-760 |
| 2101009 | CIF Paper | C24 H23 N O5 | P 21 21 21 | 8.762; 13.984; 16.569 90; 90; 90 | 2030.2 | Lenstra, A. T. H.; Geise, H. J.; De Vos, E.; Esmans, E. L.; Alderweireldt, F. C.; Dillen, J. L. M. 2-(2,4:3,5-Di-<i>O</i>-benzylidene-<small>D</small>-<i>glycero</i>-<small>D</small>-<i>allo</i>-pentitol-1-yl)pyridine, C~24~H~23~NO~5~ Acta Crystallographica Section B, 1993, 49, 699-703 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!