Crystallography Open Database

Information card for entry 4324464

Preview

Coordinates	4324464.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Mg-Formate-1
Formula	C14 H12 Mg6 N O24
Calculated formula	C14 H12 Mg6 N O24
Title of publication	Structure and Gas Sorption Behavior of a New Three Dimensional Porous Magnesium Formate
Authors of publication	Arijit Mallick; Subhadeep Saha; Pradip Pachfule; Sudip Roy; Rahul Banerjee
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	1392 - 1401
a	9.9638 ± 0.0018 Å
b	18.45 ± 0.003 Å
c	18.082 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3324.1 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.1337
Residual factor for significantly intense reflections	0.0687
Weighted residual factors for significantly intense reflections	0.1257
Weighted residual factors for all reflections included in the refinement	0.1567
Goodness-of-fit parameter for all reflections included in the refinement	0.937
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179347 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/44.	4324464.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324464.cif
41172	2012-03-12	../uploads/cif-deposit/cod/cif Adding structures of 4324464 via cif-deposit CGI script.	4324464.cif