Crystallography Open Database

Information card for entry 1570950

Preview

Coordinates	1570950.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H37 B7 Os2
Calculated formula	C20 H37 B7 Os2
SMILES	[BH]123[BH]45[BH]678[BH]9%10%11[BH]%12[Os]%13%14%15%16%172%10([BH]69[BH]147%13)([c]1([c]%17([c]%16([c]%15([c]%141C)C)C)C)C)[Os]1246358%11%12[c]3([c]1([c]2([c]4([c]63C)C)C)C)C
Title of publication	Rule breaker boron clusters: a new class of hypoelectronic osmaborane clusters [(Cp*Os)<sub>2</sub>B<sub><i>n</i></sub>H<sub><i>n</i></sub>] (<i>n</i> = 6-10).
Authors of publication	Kar, Ketaki; Kar, Sourav; Ghosh, Sundargopal
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	11
Pages of publication	4179 - 4186
a	23.6454 ± 0.0008 Å
b	23.6454 ± 0.0008 Å
c	8.8984 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	4975.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0289
Residual factor for significantly intense reflections	0.0218
Weighted residual factors for significantly intense reflections	0.0376
Weighted residual factors for all reflections included in the refinement	0.0407
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
290849 (current)	2024-04-05	cif/ Updating files of 1570947, 1570948, 1570949, 1570950, 1570951 Original log message: Adding full bibliography for 1570947--1570951.cif.	1570950.cif
289740	2024-02-08	cif/ Adding structures of 1570947, 1570948, 1570949, 1570950, 1570951 via cif-deposit CGI script.	1570950.cif