Crystallography Open Database

Information card for entry 1520288

1520287 << 1520288 >> 1520289

Preview

Coordinates	1520288.cif

Structure parameters

Formula	C4 H11 Nd2 O14 P2
Calculated formula	C4 H11 Nd2 O14 P2
Title of publication	C4 H11 Nd2 O14 P2
Authors of publication	Fogg, Andrew; Nicholls, Jennifer; Tizzard, Graham J.; Hursthouse, Michael B.; Lamond, Steven J.
Journal of publication	Crystal Structure Report Archive
Year of publication	2009
Pages of publication	1230
a	8.9198 ± 0.0003 Å
b	8.9196 ± 0.0002 Å
c	9.7074 ± 0.0003 Å
α	107.751 ± 0.002°
β	110.165 ± 0.001°
γ	91.715 ± 0.002°
Cell volume	682.55 ± 0.04 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0237
Residual factor for significantly intense reflections	0.0214
Weighted residual factors for significantly intense reflections	0.047
Weighted residual factors for all reflections included in the refinement	0.0486
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520288.cif
137970	2015-06-04	cif/ Adding structures of 1520288 via cif-deposit CGI script.	1520288.cif