Crystallography Open Database

Information card for entry 4341265

Preview

Coordinates	4341265.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H104 Hf11 N13 O102.5 S16
Calculated formula	Hf11 N13 O102.5 S16
Title of publication	Aqueous hafnium sulfate chemistry: structures of crystalline precipitates.
Authors of publication	Kalaji, Ali; Soderholm, L.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	20
Pages of publication	11252 - 11260
a	14.9489 ± 0.0005 Å
b	30.115 ± 0.001 Å
c	23.2134 ± 0.0008 Å
α	90°
β	102.36 ± 0.001°
γ	90°
Cell volume	10208.1 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0606
Residual factor for significantly intense reflections	0.0468
Weighted residual factors for significantly intense reflections	0.112
Weighted residual factors for all reflections included in the refinement	0.1187
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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.	4341265.cif
126904	2014-11-12	cif/ Updating files of 4341262, 4341263, 4341264, 4341265, 4341266, 4341267 Original log message: Adding full bibliography for 4341262--4341267.cif.	4341265.cif
125235	2014-10-10	cif/ Adding structures of 4341262, 4341263, 4341264, 4341265, 4341266, 4341267 via cif-deposit CGI script.	4341265.cif