Crystallography Open Database

Information card for entry 4504757

Preview

Coordinates	4504757.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H34 N2 Nd2 O26 P4
Calculated formula	C12 H34 N2 Nd2 O26 P4
Title of publication	Introducing a Second Ligand: New Route to Luminescent Lanthanide Polyphosphonates
Authors of publication	Ying, Shao-Ming; Mao, Jiang-Gao
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	4
Pages of publication	964
a	9.5478 ± 0.0009 Å
b	9.729 ± 0.0009 Å
c	9.7786 ± 0.001 Å
α	106.749 ± 0.002°
β	98.668 ± 0.001°
γ	110.262 ± 0.002°
Cell volume	783.61 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0438
Residual factor for significantly intense reflections	0.0356
Weighted residual factors for significantly intense reflections	0.0587
Weighted residual factors for all reflections included in the refinement	0.0622
Goodness-of-fit parameter for all reflections included in the refinement	1.094
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
179582 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/47.	4504757.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504757.cif
47510	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4504757 via cif-deposit CGI script.	4504757.cif