Crystallography Open Database

Information card for entry 4314851

Preview

Coordinates	4314851.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H86 N8 O73 S2 W18
Calculated formula	C12.5 N7.4 O69.7 S2 W18
Title of publication	Cation Controlled Assembly and Transformation of Mono- and Bi-Sulfite Templated Dawson-Type Polyoxotungstates
Authors of publication	Jun Yan; De-Liang Long; Haralampos N. Miras; Leroy Cronin
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	1819 - 1825
a	13.8974 ± 0.0002 Å
b	21.4577 ± 0.0003 Å
c	15.9687 ± 0.0002 Å
α	90°
β	92.38 ± 0.001°
γ	90°
Cell volume	4757.86 ± 0.11 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0619
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.1134
Goodness-of-fit parameter for all reflections included in the refinement	0.987
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4314851.html