Crystallography Open Database

Information card for entry 4108735

Preview

Coordinates	4108735.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 Cl3 Mn O5 Si
Calculated formula	C5 Cl3 Mn O5 Si
SMILES	[Mn]([Si](Cl)(Cl)Cl)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
Title of publication	Higher Manganese Silicide Nanowires of Nowotny Chimney Ladder Phase
Authors of publication	Jeremy M. Higgins; Andrew L. Schmitt; Ilia A. Guzei; Song Jin
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	16086 - 16094
a	13.7643 ± 0.0005 Å
b	12.5749 ± 0.0004 Å
c	12.7096 ± 0.0004 Å
α	90°
β	96.977 ± 0.002°
γ	90°
Cell volume	2183.55 ± 0.13 Å³
Cell temperature	102 ± 2 K
Ambient diffraction temperature	102 ± 2 K
Number of distinct elements	5
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	0.0301
Residual factor for significantly intense reflections	0.0264
Weighted residual factors for significantly intense reflections	0.0696
Weighted residual factors for all reflections included in the refinement	0.0725
Goodness-of-fit parameter for all reflections included in the refinement	0.911
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	Cu-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4108735.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4108735.cif
57103	2012-05-16	cif/ Adding structures of 4108735 via cif-deposit CGI script.	4108735.cif