Crystallography Open Database

Information card for entry 4300596

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Coordinates	4300596.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H10 Cl2 Cu N2
Calculated formula	C3 H10 Cl2 Cu N2
Title of publication	Magneto-Structural Correlations in Cu(tn)Cl2 (tn = 1,3-diaminopropane): Two-dime Spatially Anisotropic Triangular Magnet Formed by Hydrogen Bonds
Authors of publication	Zeleňák, Vladimír; Orendáčová, Alžbeta; Císařová, Ivana; Černák, Juraj; Kravchyna, Oxana. V.; Park, Ju-Hyun; Orendáč, Martin; Anders, Alexander. G.; Feher, Alexander; Meisel, Mark. W.
Journal of publication	Inorganic Chemistry
Year of publication	2006
a	17.956 ± 0.0001 Å
b	6.895 ± 0.0002 Å
c	5.71 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	706.94 ± 0.07 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Has coordinates	Yes
Has disorder	Yes
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.	4300596.cif
120677	2014-07-23	cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot.	4300596.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4300596.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.	4300596.cif
725	2009-05-14	cif/: Fixing the misspelled _atom_site_symetry_multiplicity tag: saulius@delfinas checks/ > pwd /home/saulius/struct/cod/cif/checks saulius@delfinas checks/ > find ../[2-9]/ -name \*.cif \ \| xargs grep -l _atom_site_symetry_multiplicity \ \| xargs -n1 -t \ perl -i -pe 's/_atom_site_symetry_multiplicity/_atom_site_symmetry_multiplicity/'	4300596.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/'	4300596.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	4300596.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.	4300596.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)	4300596.cif