Crystallography Open Database

Information card for entry 4314720

Preview

Coordinates	4314720.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H56 N2 P4 Pb Se4
Calculated formula	C24 H56 N2 P4 Pb Se4
Title of publication	Synthesis, Structures, and Multinuclear NMR Spectra of Tin(II) and Lead(II) Complexes of Tellurium-Containing Imidodiphosphinate Ligands: Preparation of Two Morphologies of Phase-Pure PbTe from a Single-Source Precursor
Authors of publication	Jamie S. Ritch; Tristram Chivers; Kibriya Ahmad; Mohammad Afzaal; Paul O'Brien
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	1198 - 1205
a	9.4939 ± 0.0019 Å
b	14.531 ± 0.003 Å
c	15.967 ± 0.003 Å
α	74.94 ± 0.03°
β	87.83 ± 0.03°
γ	85.25 ± 0.03°
Cell volume	2119.5 ± 0.8 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0555
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.0968
Weighted residual factors for all reflections included in the refinement	0.1009
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
179227 (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 4/31/47.	4314720.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4314720.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4314720.cif
17004	2011-03-31	cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif \| sort \| xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} \| > cif_filter --add-cif-header {} \| > sponge {} ) 2>&1 \| grep NOTE; then svn revert {}; > fi' ) &	4314720.cif
7863	2011-02-02	../uploads/cif-deposit/cod/cif Adding structures of 4314720 via cif-deposit CGI script.	4314720.cif