Crystallography Open Database

Information card for entry 4119298

4119297 << 4119298 >> 4119299

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Coordinates	4119298.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 Cr O3 Pd
Calculated formula	C16 H14 Cr O3 Pd
Title of publication	Electron-Deficient η1-Indenyl,η3-allylpalladium(II) Complexes Stabilized by Fluxional Non-covalent Interactions
Authors of publication	Christophe Werlé; Mustapha Hamdaoui; Corinne Bailly; Xavier-Frédéric Le Goff; Lydia Brelot; Jean-Pierre Djukic
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	1715 - 1718
a	11.887 ± 0.0006 Å
b	7.8928 ± 0.0004 Å
c	18.9704 ± 0.0007 Å
α	90°
β	124.807 ± 0.002°
γ	90°
Cell volume	1461.39 ± 0.12 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0551
Weighted residual factors for all reflections included in the refinement	0.0592
Goodness-of-fit parameter for all reflections included in the refinement	0.996
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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