Crystallography Open Database

Information card for entry 4342108

Preview

Coordinates	4342108.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B22 H32 O55 Sm4
Calculated formula	B22 O55 Sm4
Title of publication	Ionothermal Synthesis of Tetranuclear Borate Clusters Containing f- and p-Block Metals.
Authors of publication	Parker, T. Gannon; Chown, Amanda L.; Beehler, Austin; Pubbi, Divya; Cross, Justin N.; Albrecht-Schmitt, Thomas E
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	2
Pages of publication	570 - 575
a	17.9574 ± 0.0007 Å
b	17.9574 ± 0.0007 Å
c	17.9574 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	5790.7 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	197
Hermann-Mauguin space group symbol	I 2 3
Hall space group symbol	I 2 2 3
Residual factor for all reflections	0.0576
Residual factor for significantly intense reflections	0.0567
Weighted residual factors for significantly intense reflections	0.1543
Weighted residual factors for all reflections included in the refinement	0.1549
Goodness-of-fit parameter for all reflections included in the refinement	1.105
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179524 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/21.	4342108.cif
130509	2015-02-04	cif/ Updating files of 4342104, 4342105, 4342106, 4342107, 4342108, 4342109, 4342110, 4342111, 4342112 Original log message: Adding full bibliography for 4342104--4342112.cif.	4342108.cif
129810	2015-01-17	cif/ Adding structures of 4342104, 4342105, 4342106, 4342107, 4342108, 4342109, 4342110, 4342111, 4342112 via cif-deposit CGI script.	4342108.cif