Crystallography Open Database

Information card for entry 4327363

Preview

Coordinates	4327363.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cs Mn Se3 Sm
Calculated formula	Cs Mn Se3 Sm
Title of publication	Syntheses, Structure, and Selected Physical Properties of CsLnMnSe3 (Ln = Sm, Gd, Tb, Dy, Ho, Er, Tm, Yb, Y) and AYbZnQ3 (A = Rb, Cs; Q = S, Se, Te)
Authors of publication	Kwasi Mitchell; Fu Qiang Huang; El'ad N. Caspi; Adam D. McFarland; Christy L. Haynes; Rebecca C. Somers; James D. Jorgensen; Richard P. Van Duyne; James A. Ibers
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	1082 - 1089
a	4.2618 ± 0.0007 Å
b	15.715 ± 0.003 Å
c	11.2232 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	751.7 ± 0.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	4
Space group number	63
Hermann-Mauguin space group symbol	C m c m
Hall space group symbol	-C 2c 2
Residual factor for all reflections	0.0184
Residual factor for significantly intense reflections	0.0177
Weighted residual factors for significantly intense reflections	0.0481
Weighted residual factors for all reflections included in the refinement	0.0486
Goodness-of-fit parameter for all reflections included in the refinement	0.981
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
179376 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/73.	4327363.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4327363.cif
61134	2012-06-25	cif/ Adding structures of 4327363 via cif-deposit CGI script.	4327363.cif