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Information card for entry 8100706
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Coordinates | 8100706.cif |
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Formula | C18 H24 O3 |
---|---|
Calculated formula | C18 H24 O3 |
Title of publication | Crystal structure of methyl 4aSR,5RS,12aRS-12a-hydroxy-1,2,3,4,4a, 5,6,11,12,12a-decahydro-dibenzo[a,e][8]annulene-5-carboxylate, C~18~H~24~O~3~ |
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 | 423 - 424 |
a | 5.9054 ± 0.001 Å |
b | 31.84 ± 0.004 Å |
c | 8.743 ± 0.002 Å |
α | 90 ± 0.01° |
β | 104.504 ± 0.01° |
γ | 90 ± 0.01° |
Cell volume | 1591.6 ± 0.5 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/a 1 |
Hall space group symbol | -P 2yab |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176343 (current) | 2016-02-11 | cif/ (antanas@kurmis) Replacing _[local]_cod_depositor_comments tag with _cod_depositor_comments in multiple entries since this tag is widely used in the COD and formally defined in the COD CIF dictionary. All other _[local]_cod_* tags in the affected entries were also replaced with the appropriate tags without the '_[local]' prefix (except for the _[local]_cod_citation_special_details tag that was not affected since it does not yet have a formal definition in the COD CIF dictionary). |
8100706.cif |
103374 | 2014-03-03 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8100706.cif |
100680 | 2014-02-06 | cif/8/10/ (antanas@lokys.ibt.lt) Added paper volumes. |
8100706.cif |
86236 | 2013-05-14 | Fix for CIF 8100706-7 | 8100706.cif |
35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8100706.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. |
8100706.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. |
8100706.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/' |
8100706.cif |
14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
8100706.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. |
8100706.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) |
8100706.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.