Crystallography Open Database

Information card for entry 7036827

Preview

Coordinates	7036827.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C189 H294 Ag42 N6 Nb6 O83 Si2 W18
Calculated formula	C189 H279 Ag42 N6 Nb6 O83 Si2 W18
Title of publication	Control over the preference for binding sites of polyoxometalates to silver ethynide clusters by surface charge modification.
Authors of publication	Tamari, Sho; Ono, Kosuke; Hashimoto, Masato; Ozeki, Tomoji
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	44
Pages of publication	19056 - 19058
a	21.172 ± 0.001 Å
b	24.383 ± 0.001 Å
c	31.63 ± 0.001 Å
α	90.138 ± 0.001°
β	95.802 ± 0.002°
γ	93.545 ± 0.001°
Cell volume	16213.2 ± 1.1 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1114
Residual factor for significantly intense reflections	0.0823
Weighted residual factors for significantly intense reflections	0.2272
Weighted residual factors for all reflections included in the refinement	0.2425
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.689 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
211332 (current)	2018-10-05	cif/ Fixing enumeration values for CIF data items _atom_sites_solution_* using cif_fix_values. Data item relocations and exclusion of CIF comment lines might have occurred due to the usage of cif_filter.	7036827.cif
171218	2015-12-09	cif/ Updating files of 7036827 Original log message: Adding full bibliography for 7036827.cif.	7036827.cif
161114	2015-10-09	cif/ Adding structures of 7036827 via cif-deposit CGI script.	7036827.cif