Crystallography Open Database

Information card for entry 7100412

Preview

Coordinates	7100412.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H36 F15 N6 Rh
Calculated formula	C55 H36 F15 N6 Rh
Title of publication	Synthesis and Characterization of RhIII Corroles: Unusual Reactivity Patterns Observed During Metallation reactions
Authors of publication	Jim Collman; Richard A Decreau; Todd A. Eberspacher; Christopher J. Sunderland; Hong Wang
Journal of publication	Chemical Communications
Year of publication	2005
a	8.6618 ± 0.0015 Å
b	16.427 ± 0.003 Å
c	33.971 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	4833.7 ± 1.4 Å³
Cell temperature	141 ± 2 K
Ambient diffraction temperature	141 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
134198 (current)	2015-03-20	cod/ (robertas@burundukas) The values of the tag '_exptl_crystal_density_meas' were modified, if they contained units or temperature. New tags for their temperatures were created.	7100412.cif
130149	2015-01-27	cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command.	7100412.cif
130086	2015-01-23	cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ \| xargs -i sh -c 'cif_fix_values {} \ \| cif_filter --add-cif-header {} \ \| sponge {}'	7100412.cif
120677	2014-07-23	cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot.	7100412.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7100412.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.	7100412.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/'	7100412.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	7100412.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.	7100412.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)	7100412.cif