Crystallography Open Database

Information card for entry 7008318

Preview

Coordinates	7008318.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H59 Cl N3 Si2 Sm
Calculated formula	C35 H59 Cl N3 Si2 Sm
SMILES	[Sm]1(Cl)(N([Si](C)(C)C)[Si](C)(C)C)[N](=C(C)C=C(N1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C
Title of publication	Synthesis and characterization of mono beta-diketiminatosamarium amides and hydrocarbyls.
Authors of publication	Cui, Chunming; Shafir, Alexandr; Schmidt, Joseph A. R.; Oliver, Allen G.; Arnold, John
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2005
Journal issue	8
Pages of publication	1387 - 1393
a	17.208 ± 0.003 Å
b	18.256 ± 0.004 Å
c	13.022 ± 0.003 Å
α	90°
β	103.74 ± 0.03°
γ	90°
Cell volume	3973.8 ± 1.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 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	0.0408
Residual factor for significantly intense reflections	0.031
Weighted residual factors for significantly intense reflections	0.0744
Weighted residual factors for all reflections included in the refinement	0.0776
Goodness-of-fit parameter for all reflections included in the refinement	0.979
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
179787 (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 7/00/83.	7008318.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7008318.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7008318.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7008318.cif