Crystallography Open Database
Search results
Result: there are 10718 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
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2102596 | CIF HKL Paper | C15 H15 N O | P n a 21 | 12.2403; 13.8088; 7.4287 90; 90; 90 | 1255.63 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Torsional vibration and central bond length of <i>N</i>-benzylideneanilines Acta Crystallographica Section B, 2004, 60, 578-588 |
| 2102597 | CIF HKL Paper | C15 H15 N O | P n a 21 | 12.0319; 13.819; 7.263 90; 90; 90 | 1207.6 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Torsional vibration and central bond length of <i>N</i>-benzylideneanilines Acta Crystallographica Section B, 2004, 60, 578-588 |
| 2102598 | CIF Paper | C13 H10 N2 O2 | P 1 21/n 1 | 14.6363; 10.8175; 14.7228 90; 101.943; 90 | 2280.6 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102599 | CIF Paper | C13 H10 N2 O2 | P 1 21/n 1 | 14.4053; 10.7367; 14.7627 90; 101.617; 90 | 2236.5 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102600 | CIF HKL Paper | C13 H10 N2 O2 | P 1 21/n 1 | 14.2105; 10.6596; 14.8045 90; 101.228; 90 | 2199.6 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102601 | CIF HKL Paper | C14 H12 Cl N | P 1 21/a 1 | 5.9663; 7.3989; 13.7221 90; 99.12; 90 | 598.09 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102602 | CIF HKL Paper | C14 H12 Cl N | P 1 21/a 1 | 5.9174; 7.2879; 13.7049 90; 99.233; 90 | 583.37 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102603 | CIF Paper | C14 H12 Cl N | P 1 21/a 1 | 5.8827; 7.1953; 13.6919 90; 99.385; 90 | 571.79 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102604 | CIF HKL Paper | C15 H15 N | P 1 21/c 1 | 9.8766; 4.8839; 12.0187 90; 90.499; 90 | 579.72 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102605 | CIF HKL Paper | C15 H15 N | P 1 21/c 1 | 9.8649; 4.8663; 11.9484 90; 90.518; 90 | 573.57 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102606 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.8565; 4.8494; 11.8748 90; 90.561; 90 | 567.57 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102607 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.8477; 4.8327; 11.7991 90; 90.631; 90 | 561.5 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102608 | CIF HKL Paper | C15 H15 N | P 1 21/c 1 | 9.8184; 4.8159; 11.7536 90; 90.689; 90 | 555.72 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102609 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.7961; 4.8169; 11.7947 90; 90.614; 90 | 556.52 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102610 | CIF HKL Paper | C15 H15 N | P 1 21/c 1 | 9.8177; 4.815; 11.7497 90; 90.691; 90 | 555.39 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102611 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.8781; 4.8848; 12.0214 90; 90.488; 90 | 580.04 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102612 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.8785; 4.8853; 12.0209 90; 90.489; 90 | 580.1 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102613 | CIF Paper | C15 H15 N | P 1 21/c 1 | 9.7951; 4.8164; 11.7933 90; 90.617; 90 | 556.34 | Harada, Jun; Harakawa, Mayuko; Ogawa, Keiichiro Conformational change of <i>N</i>-benzylideneanilines in crystals Acta Crystallographica Section B, 2004, 60, 589-597 |
| 2102614 | CIF Paper | C16 H8 F4 I2 N2 O2 | P -1 | 4.2279; 8.009; 13.569 101.18; 98.946; 102.349 | 430.91 | Riccardo Bianchi; Alessandra Forni; Tullio Pilati Experimental Electron Density Study of the Supramolecular Aggregation between 4,4'-dipyridyl-N,N'-dioxide and 1,4-diiodotetrafluorobenzene at 90K Acta Crystallographica, Section B, 2004, 60, 559-568 |
| 2102615 | CIF Paper | C13.08 H25 N3 O6 | P 31 2 1 | 16.0682; 16.0682; 11.5317 90; 90; 120 | 2578.4 | Görbitz, Carl Henrik A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine Acta Crystallographica Section B, 2004, 60, 569-577 |
| 2102616 | CIF Paper | C13.8 H27.2 N3.4 O4.7 | P 21 21 2 | 16.2957; 23.426; 9.5842 90; 90; 90 | 3658.7 | Görbitz, Carl Henrik A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine Acta Crystallographica Section B, 2004, 60, 569-577 |
| 2102617 | CIF Paper | C12 H28 N2 O5 | P 21 21 21 | 7.6341; 12.5335; 16.3923 90; 90; 90 | 1568.45 | Görbitz, Carl Henrik A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine Acta Crystallographica Section B, 2004, 60, 569-577 |
| 2102618 | CIF Paper | C12 H27 N3 O3 | P 1 | 6.7765; 9.718; 11.882 81.58; 80.484; 88.35 | 763.4 | Görbitz, Carl Henrik A crystallographic titration of the dipeptide <small>L</small>-isoleucyl-<small>L</small>-isoleucine Acta Crystallographica Section B, 2004, 60, 569-577 |
| 2102619 | CIF Paper | C18 H12 N2 O10 S2 | C 1 2/c 1 | 11.667; 10.803; 15.868 90; 108.2; 90 | 1900 | Munro, Orde Quentin; Mariah, Lynette Conformational analysis: crystallographic, molecular mechanics and quantum chemical studies of C—H···O hydrogen bonding in the flexible bis(nosylate) derivative of catechol Acta Crystallographica Section B, 2004, 60, 598-608 |
| 2102620 | CIF Paper | C10 H14 Br2 Cl6 N2 O2 Pt | P 1 21/n 1 | 10.634; 9.131; 11.03 90; 108.076; 90 | 1018.14 | Zordan, Fiorenzo; Brammer, Lee Water molecules insert into N—H···Cl—<i>M</i> hydrogen bonds while <i>M</i>—Cl···<i>X</i>—C halogen bonds remain intact in dihydrates of halopyridinium hexachloroplatinates Acta Crystallographica Section B, 2004, 60, 512-519 |
| 2102621 | CIF Paper | C10 H14 Cl6 I2 N2 O2 Pt | P 1 2/n 1 | 7.968; 7.32; 18.243 90; 100.3; 90 | 1046.9 | Zordan, Fiorenzo; Brammer, Lee Water molecules insert into N—H···Cl—<i>M</i> hydrogen bonds while <i>M</i>—Cl···<i>X</i>—C halogen bonds remain intact in dihydrates of halopyridinium hexachloroplatinates Acta Crystallographica Section B, 2004, 60, 512-519 |
| 2102622 | CIF Paper | C10 H14 Cl6 I2 N2 O2 Pt | P -1 | 7.395; 11.002; 13.727 97.453; 95.101; 103.968 | 1066.2 | Zordan, Fiorenzo; Brammer, Lee Water molecules insert into N—H···Cl—<i>M</i> hydrogen bonds while <i>M</i>—Cl···<i>X</i>—C halogen bonds remain intact in dihydrates of halopyridinium hexachloroplatinates Acta Crystallographica Section B, 2004, 60, 512-519 |
| 2102623 | CIF Paper | C8 H6 Br I N2 O3 | P -1 | 4.797; 7.673; 15.654 96.98; 97.03; 103.34 | 549.7 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102624 | CIF Paper | C7 H5 N3 O6 | C 1 2/c 1 | 13.644; 9.55; 8.754 90; 121.31; 90 | 974.5 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102625 | CIF Paper | C7 H5 N3 O6 | P -1 | 7.7; 8.329; 8.694 87.89; 65.1; 67.33 | 461.4 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102626 | CIF Paper | C9 H9 N3 O5 | P 1 21/c 1 | 9.686; 11.368; 9.976 90; 98.74; 90 | 1085.7 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102627 | CIF Paper | C9 H10 N2 O3 | P 1 21/c 1 | 10.43; 9.991; 9.574 90; 99.51; 90 | 984 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102628 | CIF Paper | C14 H14 N6 O8 | C m c 21 | 12.239; 10.582; 13.582 90; 90; 90 | 1759 | Demartin, Francesco; Filippini, Giuseppe; Gavezzotti, Angelo; Rizzato, Silvia X-ray diffraction and packing analysis on vintage crystals: Wilhelm Koerner's nitrobenzene derivatives from the School of Agricultural Sciences in Milano Acta Crystallographica Section B, 2004, 60, 609-620 |
| 2102629 | CIF Paper | Ba Cu O6 Si2 | I 41/a c d :2 | 10.0091; 10.0091; 22.467 90; 90; 90 | 2250.8 | Sparta, Karine M.; Roth, Georg Reinvestigation of the structure of BaCuSi~2~O~6~ – evidence for a phase transition at high temperature Acta Crystallographica Section B, 2004, 60, 491-495 |
| 2102630 | CIF Paper | Ba Cu O6 Si2 | I 4/m m m | 7.1104; 7.1104; 11.175 90; 90; 90 | 565 | Sparta, Karine M.; Roth, Georg Reinvestigation of the structure of BaCuSi~2~O~6~ – evidence for a phase transition at high temperature Acta Crystallographica Section B, 2004, 60, 491-495 |
| 2102631 | CIF Paper | C122 H56 Ba Co N4 | C 1 2 1 | 25.169; 15.018; 19.429 90; 93.3; 90 | 7332 | Karen Friese; Martin Panthöfer; Guang Wu; Martin Jansen ? Acta Crystallographica, Section B, 2004, 60, 520-527 |
| 2102632 | CIF Paper | C18 H30 B2 Br6 F8 Fe N24 | P 1 21/c 1 | 12.2832; 18.0705; 10.4767 90; 90.106; 90 | 2325.4 | Dova, Eva; Peschar, René; Sakata, Makoto; Kato, Kenichi; Stassen, Arno F.; Schenk, Henk; Haasnoot, Jaap G. Structures of Fe^II^ spin-crossover complexes from synchrotron powder-diffraction data Acta Crystallographica Section B, 2004, 60, 528-538 |
| 2102633 | CIF Paper | C18 H30 B2 Br6 F8 Fe N24 | P 1 21/c 1 | 11.9297; 17.8169; 10.2874 90; 89.992; 90 | 2186.59 | Dova, Eva; Peschar, René; Sakata, Makoto; Kato, Kenichi; Stassen, Arno F.; Schenk, Henk; Haasnoot, Jaap G. Structures of Fe^II^ spin-crossover complexes from synchrotron powder-diffraction data Acta Crystallographica Section B, 2004, 60, 528-538 |
| 2102634 | CIF Paper | C18 H30 B2 F8 Fe I6 N24 | P 1 21/c 1 | 12.6425; 18.0349; 10.64881 90; 90.308; 90 | 2427.96 | Dova, Eva; Peschar, René; Sakata, Makoto; Kato, Kenichi; Stassen, Arno F.; Schenk, Henk; Haasnoot, Jaap G. Structures of Fe^II^ spin-crossover complexes from synchrotron powder-diffraction data Acta Crystallographica Section B, 2004, 60, 528-538 |
| 2102635 | CIF Paper | C18 H30 B2 F8 Fe I6 N24 | P 1 21/c 1 | 12.3177; 17.6766; 10.4685 90; 90.5991; 90 | 2279.23 | Dova, Eva; Peschar, René; Sakata, Makoto; Kato, Kenichi; Stassen, Arno F.; Schenk, Henk; Haasnoot, Jaap G. Structures of Fe^II^ spin-crossover complexes from synchrotron powder-diffraction data Acta Crystallographica Section B, 2004, 60, 528-538 |
| 2102636 | CIF HKL Paper | C18 H26 Mg O14 | P 1 21/c 1 | 9.082; 7.847; 15.197 90; 96.842; 90 | 1075.32 | Langkilde, A.; Madsen, D.; Larsen, S. Structures of three salts of phthalic acid; variation in crystal packing and geometry of the hydrogen phthalate ion Acta Crystallographica Section B, 2004, 60, 502-511 |
| 2102637 | CIF HKL Paper | C12 H17 N O4 | P 1 21/c 1 | 23.289; 10.279; 15.298 90; 93.8; 90 | 3654.1 | Langkilde, A.; Madsen, D.; Larsen, S. Structures of three salts of phthalic acid; variation in crystal packing and geometry of the hydrogen phthalate ion Acta Crystallographica Section B, 2004, 60, 502-511 |
| 2102638 | CIF HKL Paper | C18 H15 N3 O4 | P 1 21/c 1 | 7.179; 9.0034; 24.61 90; 98.76; 90 | 1572.1 | Langkilde, A.; Madsen, D.; Larsen, S. Structures of three salts of phthalic acid; variation in crystal packing and geometry of the hydrogen phthalate ion Acta Crystallographica Section B, 2004, 60, 502-511 |
| 2102639 | CIF Paper | C11 H20 N2 | P b 21 a | 11.279; 20.634; 19.542 90; 90; 90 | 4548 | Sobolev, Alexandre N.; White, Allan H. Temperature dependence of the crystal structure of 3,5-di-<i>tert</i>-butylpyrazole from 10K Acta Crystallographica Section B, 2004, 60, 621-625 |
| 2102640 | CIF Paper | C11 H20 N2 | P b 21 a | 11.366; 20.654; 19.723 90; 90; 90 | 4630 | Sobolev, Alexandre N.; White, Allan H. Temperature dependence of the crystal structure of 3,5-di-<i>tert</i>-butylpyrazole from 10K Acta Crystallographica Section B, 2004, 60, 621-625 |
| 2102641 | CIF Paper | C11 H20 N2 | P b c a | 11.356; 20.637; 9.85 90; 90; 90 | 2308.4 | Sobolev, Alexandre N.; White, Allan H. Temperature dependence of the crystal structure of 3,5-di-<i>tert</i>-butylpyrazole from 10K Acta Crystallographica Section B, 2004, 60, 621-625 |
| 2102642 | CIF Paper | C11 H20 N2 | P b c a | 11.482; 21.13; 9.992 90; 90; 90 | 2424.2 | Sobolev, Alexandre N.; White, Allan H. Temperature dependence of the crystal structure of 3,5-di-<i>tert</i>-butylpyrazole from 10K Acta Crystallographica Section B, 2004, 60, 621-625 |
| 2102643 | CIF Paper | Cr2 K2 O7 | P -1 | 7.3837; 7.4622; 13.3949 96.204; 98.046; 90.943 | 726.12 | Weakley, T. J. R.; Ylvisaker, E. R.; Yager, R. J.; Stephens, J. E.; Wiegel, R. D.; Mengis, M.; Bauer, M. R.; Wu, P.; Photinos, P.; Abrahams, S. C. Phase transitions in K~2~Cr~2~O~7~ and structural redeterminations of phase II Acta Crystallographica, Section B: Structural Science, 2004, 60, 705-715 |
| 2102644 | CIF Paper | Cr2 K2 O7 | P -1 | 7.3807; 7.4593; 13.391 96.205; 98.033; 90.914 | 725.37 | Weakley, T. J. R.; Ylvisaker, E. R.; Yager, R. J.; Stephens, J. E.; Wiegel, R. D.; Mengis, M.; Bauer, M. R.; Wu, P.; Photinos, P.; Abrahams, S. C. Phase transitions in K~2~Cr~2~O~7~ and structural redeterminations of phase II Acta Crystallographica, Section B: Structural Science, 2004, 60, 705-715 |
| 2102645 | CIF Paper | C12 H8 Br2 O | C c c 2 | 26.645; 7.6902; 5.7223 90; 90; 90 | 1172.5 | Eriksson, Lars; Eriksson, Johan; Hu, Jiwei Di-<i>p</i>-bromophenyl ether, a redetermined crystal structure derived from low-quality diffraction data Acta Crystallographica Section B, 2004, 60, 734-738 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!