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Information card for entry 8100707
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| Coordinates | 8100707.cif |
|---|
| Formula | C16 H16 O2 |
|---|---|
| Calculated formula | C16 H16 O2 |
| Title of publication | Crystal structure of 2SR,5SR,5aSR,11bSR-5-methyl-1,5,5a,11b-tetrahydro- 2,5-methanonaphtho[2,1-c]oxepin-3(2H)-one, C~16~H~16~O~2~ |
| Authors of publication | Rademacher, O.; Zimmer, R.; Dinesh, C.U.; Reißig, H.-U. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2002 |
| Journal volume | 217 |
| Journal issue | 3 |
| Pages of publication | 425 - 426 |
| a | 12.475 ± 0.004 Å |
| b | 7.515 ± 0.005 Å |
| c | 13.259 ± 0.004 Å |
| α | 90 ± 0.03° |
| β | 95.55 ± 0.03° |
| γ | 90 ± 0.03° |
| Cell volume | 1237.3 ± 1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176342 (current) | 2016-02-11 | cif/ (antanas@kurmis) Merging the values of _[local]_cod_depositor_comments and _cod_depositor_comments tags in files where both tags were present. Also, deprecated _[local]_cod_* tags were replaced with their replacement tags. |
8100707.cif |
| 103374 | 2014-03-03 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8100707.cif |
| 100680 | 2014-02-06 | cif/8/10/ (antanas@lokys.ibt.lt) Added paper volumes. |
8100707.cif |
| 86236 | 2013-05-14 | Fix for CIF 8100706-7 | 8100707.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8100707.cif |
| 17004 | 2011-03-31 | cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif | sort | xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} | > cif_filter --add-cif-header {} | > sponge {} ) 2>&1 | grep NOTE; then svn revert {}; > fi' ) & |
8100707.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
8100707.cif |
| 853 | 2009-11-16 | cif/ Reconstructing spacegroup designators from the symmetry operators were possible. The comands used can be found in the log file reformat-spacegroups-2009.11.14.log committed with the current revision. Only lines that contained spacegroup designators were changed, and all files pass vcif test after the conversion. |
8100707.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
8100707.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
8100707.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
8100707.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
8100707.cif |
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Users of the data should acknowledge the original authors of the
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