Crystallography Open Database

Information card for entry 4326443

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Coordinates	4326443.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40.5 H35 F6 N4 O2.5 Pd
Calculated formula	C40.5 H35 F6 N4 O2.5 Pd
Title of publication	Redox-Active Bridging Ligands Based on Indigo Diimine ("Nindigo") Derivatives
Authors of publication	Graeme Nawn; Kate M. Waldie; Simon R. Oakley; Brendan D. Peters; Derek Mandel; Brian O. Patrick; Robert McDonald; Robin G. Hicks
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	9826 - 9837
a	12.0116 ± 0.0005 Å
b	12.818 ± 0.0004 Å
c	13.9589 ± 0.0006 Å
α	112.866 ± 0.001°
β	98.231 ± 0.001°
γ	107.377 ± 0.001°
Cell volume	1805.93 ± 0.12 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.052
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.0773
Weighted residual factors for all reflections included in the refinement	0.0845
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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