Crystallography Open Database

Information card for entry 7036479

Preview

Coordinates	7036479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H142 Al2 K2 N4 Sn6
Calculated formula	C82 H128 Al2 K2 N4 Sn6
SMILES	[K+].[Sn](C)(C)(C)C#C[Al]1(N(C(=[N]1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C)(C#C[Sn](C)(C)C)C#C[Sn](C)(C)C
Title of publication	Addition of in situ reduced amidinato-methylaluminium chloride to acetylenes.
Authors of publication	Chlupatý, T; Turek, J.; De Proft, F.; Růžičková, Z; Růžička, A
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	40
Pages of publication	17462 - 17466
a	17.7131 ± 0.001 Å
b	14.447 ± 0.0012 Å
c	25.0359 ± 0.0014 Å
α	90°
β	126.853 ± 0.005°
γ	90°
Cell volume	5126.5 ± 0.7 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	6
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	0.0559
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0622
Weighted residual factors for all reflections included in the refinement	0.0797
Goodness-of-fit parameter for all reflections included in the refinement	1.205
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
161909 (current)	2015-10-09	cif/ Updating files of 7036477, 7036478, 7036479 Original log message: Adding full bibliography for 7036477--7036479.cif.	7036479.cif
155863	2015-09-11	cif/ Adding structures of 7036477, 7036478, 7036479 via cif-deposit CGI script.	7036479.cif