Crystallography Open Database

Information card for entry 4333634

Preview

Coordinates	4333634.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	neodymium manganese copper arsenide (2/3/9/7)
Chemical name	neodymium manganese copper arsenide (2/3/9/7)
Formula	As7 Cu9 Mn3 Nd2
Calculated formula	As7 Cu9 Mn3 Nd2
Title of publication	Rare-Earth Manganese Copper Pnictides RE2Mn3Cu9Pn7 (Pn = P, As): Quaternary Ordered Variants of the Zr2Fe12P7-Type Structure
Authors of publication	Stanislav S. Stoyko; Krishna K. Ramachandran; C. Scott Mullen; Arthur Mar
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	1040 - 1046
a	9.913 ± 0.0003 Å
b	9.913 ± 0.0003 Å
c	3.9611 ± 0.0001 Å
α	90°
β	90°
γ	120°
Cell volume	337.098 ± 0.017 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	174
Hermann-Mauguin space group symbol	P -6
Hall space group symbol	P -6
Residual factor for all reflections	0.0223
Residual factor for significantly intense reflections	0.0223
Weighted residual factors for significantly intense reflections	0.0536
Weighted residual factors for all reflections included in the refinement	0.0536
Goodness-of-fit parameter for all reflections included in the refinement	1.369
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
179439 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/36.	4333634.cif
171491	2015-12-13	cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4.	4333634.cif
99430	2014-01-31	cif/ Adding structures of 4333634 via cif-deposit CGI script.	4333634.cif