Crystallography Open Database

Information card for entry 4316016

Preview

Coordinates	4316016.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H56 Cu3 Mo12 N16 O40 P
Calculated formula	C56 H56 Cu3 Mo12 N16 O40 P
Title of publication	Reaction Controlled Assemblies of Polyoxotungstates (-molybdates) and Coordination Polymers
Authors of publication	Guangfeng Hou; Lihua Bi; Bao Li; Lixin Wu
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	6474 - 6483
a	11.453 ± 0.004 Å
b	14.185 ± 0.007 Å
c	15.336 ± 0.005 Å
α	111.29 ± 0.016°
β	97.97 ± 0.014°
γ	110.11 ± 0.015°
Cell volume	2078.7 ± 1.5 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0526
Residual factor for significantly intense reflections	0.0466
Weighted residual factors for significantly intense reflections	0.0967
Weighted residual factors for all reflections included in the refinement	0.0997
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
179240 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/60.	4316016.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4316016.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4316016.cif
9188	2011-02-09	../uploads/cif-deposit/cod/cif Adding structures of 4316016 via cif-deposit CGI script.	4316016.cif