Crystallography Open Database

Information card for entry 4324415

Preview

Coordinates	4324415.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H16 O4 S Sn
Calculated formula	C6 H16 O4 S Sn
Title of publication	Diorganotin-Based Coordination Polymers Derived from Sulfonate/Phosphonate/Phosphonocarboxylate Ligands
Authors of publication	Ravi Shankar; Archana Jain; Gabriele Kociok-Köhn; Kieran C. Molloy
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	1339 - 1350
a	7.5018 ± 0.0003 Å
b	8.3606 ± 0.0003 Å
c	8.9734 ± 0.0003 Å
α	76.613 ± 0.002°
β	88.689 ± 0.002°
γ	86.033 ± 0.001°
Cell volume	546.19 ± 0.03 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.034
Weighted residual factors for significantly intense reflections	0.069
Weighted residual factors for all reflections included in the refinement	0.0738
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
179347 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/44.	4324415.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324415.cif
41123	2012-03-12	../uploads/cif-deposit/cod/cif Adding structures of 4324415 via cif-deposit CGI script.	4324415.cif