Crystallography Open Database

Information card for entry 7053573

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Structure parameters

Formula	C132 H226 O26 Sr4
Calculated formula	C132 H226 O26 Sr4
Title of publication	Synthesis and structural characterisation of the heavier alkaline earth 2,6-di-iso-propylphenolate complexes
Authors of publication	Deacon, Glen B.; Junk, Peter C.; Moxey, Graeme J.
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	8
Pages of publication	1731
a	20.0029 ± 0.0003 Å
b	20.0434 ± 0.0003 Å
c	22.7191 ± 0.0004 Å
α	64.454 ± 0.001°
β	72.609 ± 0.001°
γ	61.087 ± 0.001°
Cell volume	7146.6 ± 0.2 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0552
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0901
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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
301851 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure.	7053573.cif
180089	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/35.	7053573.cif
93724	2014-01-13	cif/ Adding structures of 7053572, 7053573, 7053574 via cif-deposit CGI script.	7053573.cif