Crystallography Open Database

Information card for entry 2227630

Preview

Coordinates	2227630.cif
Structure factors	2227630.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	Poly[(μ~6~-benzene-1,3,5-tricarboxylato-κ^6^<i>O</i>^1^:<i>O</i>^1'^: <i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^5^:<i>O</i>^5'^)tris(<i>N</i>,<i>N</i>- dimethylformamide-κ<i>O</i>)tris(μ~3~-formato-κ^2^<i>O</i>:<i>O</i>') trimagnesium(II)]
Formula	C7 H9 Mg N O5
Calculated formula	C7 H9 Mg N O5
Title of publication	Poly[(μ~6~-benzene-1,3,5-tricarboxylato-κ^6^<i>O</i>^1^:<i>O</i>^1'^:<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^5^:<i>O</i>^5'^)tris(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)tris(μ~3~-formato-κ^2^<i>O</i>:<i>O</i>')trimagnesium(II)]
Authors of publication	Yeh, Chun-Ting; Liu, Hsin-Kuan; Lin, Chia-Jing; Lin, Chia-Her
Journal of publication	Acta Crystallographica Section E
Year of publication	2010
Journal volume	66
Journal issue	10
Pages of publication	m1289
a	13.9739 ± 0.0002 Å
b	13.9739 ± 0.0002 Å
c	8.1188 ± 0.0001 Å
α	90°
β	90°
γ	120°
Cell volume	1372.96 ± 0.03 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	147
Hermann-Mauguin space group symbol	P -3
Hall space group symbol	-P 3
Residual factor for all reflections	0.0793
Residual factor for significantly intense reflections	0.078
Weighted residual factors for significantly intense reflections	0.2136
Weighted residual factors for all reflections included in the refinement	0.214
Goodness-of-fit parameter for all reflections included in the refinement	1.396
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181197 (current)	2016-04-03	hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/76.	2227630.cif 2227630.hkl
176789	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22.	2227630.cif 2227630.hkl
120072	2014-07-11	Adding DOIs to range 2 structures.	2227630.cif 2227630.hkl
88064	2013-08-29	Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet.	2227630.cif 2227630.hkl
26848	2011-09-28	cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree.	2227630.cif 2227630.hkl
5269	2010-12-22	hkl/ Adding Fobs data for the recent IUCr-published structres.	2227630.cif 2227630.hkl
4667	2010-12-18	../uploads/cif-deposit/cod/cif Adding structures of 2227630 via cif-deposit CGI script.	2227630.cif