Crystallography Open Database

Information card for entry 4336651

Preview

Coordinates	4336651.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Sodium neptunium(IV) neptunyl(V) hydroxide chrolide hydrate
Formula	Cl9 H16.2 Na0.8 Np7 O21
Calculated formula	Cl9 Na0.75 Np7 O21
Title of publication	Mixed-Valent Neptunium(IV/V) Compound with Cation-Cation-Bound Six-Membered Neptunyl Rings
Authors of publication	Geng Bang Jin
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12317 - 12319
a	10.9879 ± 0.0004 Å
b	10.9879 ± 0.0004 Å
c	14.3934 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	1504.95 ± 0.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0471
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.1404
Weighted residual factors for all reflections included in the refinement	0.1421
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4336651.cif
102658	2014-02-21	cif/ Adding structures of 4336651 via cif-deposit CGI script.	4336651.cif