Crystallography Open Database

Information card for entry 7010496

Preview

Coordinates	7010496.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-(mu-pyrazine dibromo zinc(II))
Formula	C4 H4 Br2 N2 Zn
Calculated formula	C4 H4 Br2 N2 Zn
Title of publication	One- and two-dimensional coordination polymers of zinc(II) with pyrazine. Solid state reactions and decomposition kinetics of the interconversion reactions
Authors of publication	Bourne, Susan A.; Kilkenny, Mairi; Nassimbeni, Luigi R.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	8
Pages of publication	1176
a	6.0068 ± 0.0004 Å
b	9.9518 ± 0.0008 Å
c	6.9936 ± 0.0006 Å
α	90°
β	110.472 ± 0.005°
γ	90°
Cell volume	391.66 ± 0.05 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0758
Residual factor for significantly intense reflections	0.0677
Weighted residual factors for significantly intense reflections	0.1739
Weighted residual factors for all reflections included in the refinement	0.1864
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
213973 (current)	2019-03-05	cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries.	7010496.cif
179808	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/04.	7010496.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7010496.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7010496.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7010496.cif