Crystallography Open Database

Information card for entry 7100378

Preview

Coordinates	7100378.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	n-amylammonium anthracene-2,6-disulfonate
Formula	C12 H18 N O3 S
Calculated formula	C12 H18 N O3 S
Journal of publication	Chemical Communications
Year of publication	2005
a	5.925 ± 0.003 Å
b	7.508 ± 0.004 Å
c	14.947 ± 0.004 Å
α	77.02 ± 0.02°
β	82.659 ± 0.008°
γ	86.15 ± 0.02°
Cell volume	642.1 ± 0.5 Å³
Cell temperature	213.2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
130149 (current)	2015-01-27	cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command.	7100378.cif
120677	2014-07-23	cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot.	7100378.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7100378.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.	7100378.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/'	7100378.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	7100378.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.	7100378.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)	7100378.cif