Crystallography Open Database

Information card for entry 4326536

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Coordinates	4326536.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H46 Mo N15 Nd O6.5
Calculated formula	C35 H43 Mo N15 Nd O6.5
Title of publication	Near-Infrared Luminescent and Magnetic Cyano-Bridged Coordination Polymers Nd(phen)n(DMF)m[M(CN)8] (M = Mo, W)
Authors of publication	Jérôme Long; Elena Chelebaeva; Joulia Larionova; Yannick Guari; Rute A. S. Ferreira; Luis D. Carlos; Filipe A. Almeida Paz; Alexander Trifonov; Christian Guérin
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	9924 - 9926
a	11.2639 ± 0.0002 Å
b	20.9739 ± 0.0003 Å
c	20.1237 ± 0.0003 Å
α	90°
β	103.742 ± 0.002°
γ	90°
Cell volume	4618.09 ± 0.13 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.061
Residual factor for significantly intense reflections	0.0528
Weighted residual factors for significantly intense reflections	0.1315
Weighted residual factors for all reflections included in the refinement	0.1367
Goodness-of-fit parameter for all reflections included in the refinement	1.162
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4326536.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4326536.cif
48831	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4326536 via cif-deposit CGI script.	4326536.cif