Crystallography Open Database

Information card for entry 4304395

Preview

Coordinates	4304395.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H34 Cl2 N4 P2 Ru
Calculated formula	C39 H34 Cl2 N4 P2 Ru
Title of publication	Ru and Os Complexes Containing a P,N-Donor Heterotopic Ligand: The Effect of Solvent on Stereochemistry
Authors of publication	Dabb, Serin L.; Messerle, Barbara A.; Smith, Matthew K.; Willis, Anthony C.
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Journal issue	8
Pages of publication	3034 - 3044
a	11.656 ± 0.002 Å
b	15.015 ± 0.003 Å
c	21.886 ± 0.004 Å
α	90°
β	98.44 ± 0.03°
γ	90°
Cell volume	3788.9 ± 1.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0828
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.1264
Weighted residual factors for all reflections included in the refinement	0.1459
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
210348 (current)	2018-09-02	cif/4/ Updating bibliography in entries 4304395-4304400, 4333500. Marking entry 4333500 as a duplicate of entry 4304396,	4304395.cif
179081	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/43.	4304395.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304395.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304395.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304395.cif