Crystallography Open Database

Information card for entry 7700434

Preview

Coordinates	7700434.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	CsSc(BH4)4
Chemical name	Cesium scandium borohydride
Formula	B4 Cs H16 Sc
Calculated formula	B4 Cs H16 Sc
Title of publication	Two new derivatives of scandium borohydride, MSc(BH<sub>4</sub>)<sub>4</sub>, M = Rb, Cs, prepared via a one-pot solvent-mediated method.
Authors of publication	Starobrat, Agnieszka; Jaroń, Tomasz; Grochala, Wojciech
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	31
Pages of publication	11829 - 11837
a	9.587 ± 0.002 Å
b	10.727 ± 0.003 Å
c	12.228 ± 0.003 Å
α	90°
β	126.351 ± 0.003°
γ	90°
Cell volume	1012.8 ± 0.4 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.109
Residual factor for significantly intense reflections	0.0472
Weighted residual factors for all reflections	0.0781
Weighted residual factors for significantly intense reflections	0.0491
Goodness-of-fit parameter for all reflections	0.05
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
224372 (current)	2019-11-08	cif/ Updating files of 7700431, 7700432, 7700433, 7700434 Original log message: Adding full bibliography for 7700431--7700434.cif.	7700434.cif
216760	2019-07-05	cif/ Adding structures of 7700431, 7700432, 7700433, 7700434 via cif-deposit CGI script.	7700434.cif