Crystallography Open Database

Information card for entry 4343322

Preview

Coordinates	4343322.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H235 Fe14 N3 Na32 O352 P8 W60
Calculated formula	Fe14 Na8.35 O277 P8 W60
Title of publication	Tetradecanuclear Iron(III)-Oxo Nanoclusters Stabilized by Trilacunary Heteropolyanions.
Authors of publication	Ibrahim, Masooma; Haider, Ali; Xiang, Yixian; Bassil, Bassem S.; Carey, Akina M.; Rullik, Lisa; Jameson, Geoffrey B.; Doungmene, Floriant; Mbomekallé, Israël M; Oliveira, Pedro de; Mereacre, Valeriu; Kostakis, George E.; Powell, Annie K.; Kortz, Ulrich
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	13
Pages of publication	6136 - 6146
a	29.784 ± 0.003 Å
b	29.784 ± 0.003 Å
c	76.121 ± 0.012 Å
α	90°
β	90°
γ	120°
Cell volume	58479 ± 12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1421
Residual factor for significantly intense reflections	0.0832
Weighted residual factors for significantly intense reflections	0.2123
Weighted residual factors for all reflections included in the refinement	0.2778
Goodness-of-fit parameter for all reflections included in the refinement	1.002
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
141321 (current)	2015-07-08	cif/ Updating files of 4343322, 4343323, 4343324 Original log message: Adding full bibliography for 4343322--4343324.cif.	4343322.cif
139158	2015-06-14	cif/ Adding structures of 4343322 via cif-deposit CGI script.	4343322.cif