Crystallography Open Database

Information card for entry 7005448

Preview

Coordinates	7005448.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C156 H196 N48 Nd4 O52 Ru6
Calculated formula	C156 H132 N48 Nd4 O52 Ru6
Title of publication	Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties
Authors of publication	Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.
Journal of publication	Dalton Transactions
Year of publication	2007
Journal issue	23
Pages of publication	2419
a	21.4922 ± 0.0012 Å
b	26.3727 ± 0.0015 Å
c	17.183 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	9739.5 ± 1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0656
Residual factor for significantly intense reflections	0.0608
Weighted residual factors for significantly intense reflections	0.1673
Weighted residual factors for all reflections included in the refinement	0.1698
Goodness-of-fit parameter for all reflections included in the refinement	1.177
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179758 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/54.	7005448.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7005448.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7005448.cif
1186	2010-06-03	Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing.	7005448.cif