Crystallography Open Database

Information card for entry 4302012

4302011 << 4302012 >> 4302013

Preview

Coordinates	4302012.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82 H163 Mn2 N6 O26 Y3
Calculated formula	C82 H163 Mn2 N6 O26 Y3
Title of publication	Family of Heterometallic Semicircular MnIII2LnIII3 Strands
Authors of publication	Muhammad Nadeem Akhtar; Yan-Zhen Zheng; Yanhua Lan; Valeriu Mereacre; Christopher E. Anson; Annie K. Powell
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	3502 - 3504
a	17.3318 ± 0.0007 Å
b	29.722 ± 0.0012 Å
c	20.4829 ± 0.0008 Å
α	90°
β	100.803 ± 0.001°
γ	90°
Cell volume	10364.5 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1019
Residual factor for significantly intense reflections	0.0524
Weighted residual factors for significantly intense reflections	0.1192
Weighted residual factors for all reflections included in the refinement	0.1399
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179058 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/20.	4302012.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4302012.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4302012.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4302012.cif