Crystallography Open Database

Information card for entry 4342338

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Coordinates	4342338.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H45 Cu7 N O48
Calculated formula	C15 H43 Cu7 N O48
Title of publication	Proton Conduction and Long-Range Ferrimagnetic Ordering in Two Isostructural Copper(II) Mesoxalate Metal-Organic Frameworks.
Authors of publication	Gil-Hernández, Beatriz; Savvin, Stanislav; Makhloufi, Gamall; Núñez, Pedro; Janiak, Christoph; Sanchiz, Joaquín
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1597 - 1605
a	8.0421 ± 0.0004 Å
b	16.749 ± 0.0007 Å
c	17.859 ± 0.0005 Å
α	63.935 ± 0.004°
β	85.106 ± 0.004°
γ	84.616 ± 0.004°
Cell volume	2148.75 ± 0.17 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0538
Residual factor for significantly intense reflections	0.0462
Weighted residual factors for significantly intense reflections	0.1177
Weighted residual factors for all reflections included in the refinement	0.1248
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179526 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/23.	4342338.cif
132782	2015-03-04	cif/ Updating files of 4342337, 4342338 Original log message: Adding full bibliography for 4342337--4342338.cif.	4342338.cif
131200	2015-02-06	cif/ Adding structures of 4342338 via cif-deposit CGI script.	4342338.cif