Crystallography Open Database

Information card for entry 4326629

Preview

Coordinates	4326629.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H18 Cl2 Mn N5 O2
Calculated formula	C19 H18 Cl2 Mn N5 O2
Title of publication	End-to-End Azide-Bridged Manganese(III) Chain Compounds: Field-Induced Magnetic Phase Transitions and Variation of TC to 38 K Depending on the Side Groups of the Schiff Bases
Authors of publication	Jung Hee Yoon; Woo Ram Lee; Dae Won Ryu; Jin Wuk Lee; Sung Won Yoon; Byoung Jin Suh; Hyoung Chan Kim; Chang Seop Hong
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	10777 - 10785
a	29.3009 ± 0.0017 Å
b	11.32 ± 0.0006 Å
c	12.0634 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	4001.3 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1543
Residual factor for significantly intense reflections	0.0541
Weighted residual factors for significantly intense reflections	0.1256
Weighted residual factors for all reflections included in the refinement	0.1915
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
179369 (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 4/32/66.	4326629.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4326629.cif
49403	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4326629 via cif-deposit CGI script.	4326629.cif