Crystallography Open Database

Information card for entry 4313320

Preview

Coordinates	4313320.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H47 Li N O2 Sb Si2
Calculated formula	C24 H47 Li N O2 Sb Si2
SMILES	[Sb]1([Li]([N](Cc2c1cccc2)(C)C)([O]1CCCC1)[O]1CCCC1)C([Si](C)(C)C)[Si](C)(C)C
Title of publication	Syntheses, Structures, and Dynamic Behavior of Chiral Racemic Organoantimony and -bismuth Compounds RR'SbCl, RR'BiCl, and RR'SbM [R = 2-(Me2NCH2)C6H4, R' = CH(Me3Si)2, M = H, Li, Na]
Authors of publication	Hans J. Breunig; Ioan Ghesner; Mihaiela E. Ghesner; Enno Lork
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	1751 - 1757
a	11.552 ± 0.002 Å
b	16.518 ± 0.003 Å
c	15.971 ± 0.005 Å
α	90°
β	96.11 ± 0.02°
γ	90°
Cell volume	3030.2 ± 1.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0749
Residual factor for significantly intense reflections	0.0595
Weighted residual factors for significantly intense reflections	0.1672
Weighted residual factors for all reflections included in the refinement	0.1787
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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
179191 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/33.	4313320.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4313320.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4313320.cif
17004	2011-03-31	cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif \| sort \| xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} \| > cif_filter --add-cif-header {} \| > sponge {} ) 2>&1 \| grep NOTE; then svn revert {}; > fi' ) &	4313320.cif
6389	2011-01-11	../uploads/cif-deposit/cod/cif Adding structures of 4313320 via cif-deposit CGI script.	4313320.cif