Crystallography Open Database

Information card for entry 7009368

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Structure parameters

Formula	C24 H60 O13 Si4
Calculated formula	C24 H58 O13 Si4
SMILES	[Si](OC(C)(C)C)(OC(C)(C)C)(OC(C)(C)C)O[Si](O)(O)O[Si](O)(O)O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
Title of publication	Synthesis and structure of the (tetrahydroxy)oligosiloxane [(tBuO)3SiOSi(OH)2]2O
Authors of publication	Rulkens, Ron; Coles, Martyn P.; Tilley, T. Don
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2000
Journal issue	5
Pages of publication	627
a	9.4952 ± 0.0006 Å
b	14.1078 ± 0.0008 Å
c	15.321 ± 0.0009 Å
α	112.688 ± 0.001°
β	93.374 ± 0.001°
γ	90.217 ± 0.001°
Cell volume	1889.5 ± 0.2 Å³
Cell temperature	273.2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0
Weighted residual factors for all reflections included in the refinement	0.0579
Goodness-of-fit parameter for all reflections included in the refinement	2.15
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
202017 (current)	2017-10-14	cif/ Marking COD entries in range 7 that are known to be related to ChemSpider entries using the _cod_related_entry data loop.	7009368.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7009368.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7009368.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7009368.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7009368.cif