Crystallography Open Database

Information card for entry 7047763

Preview

Coordinates	7047763.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H50 Be6 Cl6 O16
Calculated formula	C24 H48 Be6 Cl4 O16
Title of publication	The coordination behaviour and reactivity of partially silicon based crown ethers towards beryllium chloride.
Authors of publication	Buchner, Magnus R.; Müller, Matthias; Dankert, Fabian; Reuter, Kirsten; von Hänisch, Carsten
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	46
Pages of publication	16393 - 16397
a	19.481 ± 0.004 Å
b	9.5492 ± 0.0019 Å
c	21.762 ± 0.004 Å
α	90°
β	106.72 ± 0.03°
γ	90°
Cell volume	3877.2 ± 1.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0636
Residual factor for significantly intense reflections	0.0525
Weighted residual factors for significantly intense reflections	0.1403
Weighted residual factors for all reflections included in the refinement	0.1482
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
229635 (current)	2019-11-17	cif/ Updating files of 7047763, 7047764 Original log message: Adding full bibliography for 7047763--7047764.cif.	7047763.cif
211438	2018-10-13	cif/ Adding structures of 7047763, 7047764 via cif-deposit CGI script.	7047763.cif