Crystallography Open Database

Information card for entry 1506194

Preview

Coordinates	1506194.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H28 B10 Si2
Calculated formula	C14 H28 B10 Si2
SMILES	[Si]([C]1234[C]567([Si](C=C)(C=C)C=C)[BH]891[BH]1%102[BH]2%113[BH]345[BH]45%11[BH]%11%102[BH]291[BH]168[BH]734[BH]5%1121)(C=C)(C=C)C=C
Title of publication	Synthesis of small carboranylsilane dendrons as scaffolds for multiple functionalizations.
Authors of publication	Núñez, Rosario; Gonzalez-Campo, Arantzazu; Laromaine, Anna; Teixidor, Francesc; Sillanpää, Reijo; Kivekäs, Raikko; Viñas, Clara
Journal of publication	Organic letters
Year of publication	2006
Journal volume	8
Journal issue	20
Pages of publication	4549 - 4552
a	15.8018 ± 0.0008 Å
b	10.593 ± 0.0006 Å
c	13.4179 ± 0.0004 Å
α	90°
β	99.317 ± 0.003°
γ	90°
Cell volume	2216.37 ± 0.18 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
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	0.0787
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.1055
Weighted residual factors for all reflections included in the refinement	0.1167
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1506194.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1506194.cif
48079	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 1506194, 1506195, 1506196 via cif-deposit CGI script.	1506194.cif