Crystallography Open Database

Information card for entry 7002625

Preview

Coordinates	7002625.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(ROAl(O)DMSO)4 + 3toluene
Formula	C101 H164 Al4 O12 S4
Calculated formula	C101 H164 Al4 O12 S4
Title of publication	Synthesis of aryloxyaluminium hydrides and their conversion into aryloxyalumoxanes (ArOAlO)n
Authors of publication	Shekar, Sukesh; Taylor, Mamie M.; Twamley, Brendan; Wehmschulte, Rudolf J.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	42
Pages of publication	9322
a	14.9642 ± 0.0005 Å
b	28.4632 ± 0.001 Å
c	50.1873 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	21376.2 ± 1.3 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0728
Residual factor for significantly intense reflections	0.0527
Weighted residual factors for significantly intense reflections	0.1242
Weighted residual factors for all reflections included in the refinement	0.1365
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
179730 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/26.	7002625.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002625.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002625.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002625.cif