Crystallography Open Database

Information card for entry 4067351

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Structure parameters

Formula	C31.1 H62.25 I1.15 N7 Sr2
Calculated formula	C31.1 H62.25 I1.15 N7 Sr2
Title of publication	Stability and Reactivity of Phenylstrontium Compounds in Solution
Authors of publication	Langer, Jens; Görls, Helmar; Westerhausen, Matthias
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	9
Pages of publication	2034
a	12.7937 ± 0.0004 Å
b	18.8424 ± 0.0004 Å
c	33.487 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	8072.5 ± 0.4 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 2 K
Number of distinct elements	5
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	0.1804
Residual factor for significantly intense reflections	0.0742
Weighted residual factors for significantly intense reflections	0.1478
Weighted residual factors for all reflections included in the refinement	0.1821
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
301829 (current)	2025-08-20	Add cross-references to PubChem compounds in COD range 4/06/ Each referenced PubChem compound corresponds to the full crystal structure.	4067351.cif
176467	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4067351.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4067351.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4067351.cif
34168	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4067350, 4067351, 4067352, 4067353, 4067354 via cif-deposit CGI script.	4067351.cif