Crystallography Open Database

Information card for entry 4087591

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Coordinates	4087591.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H30 Cr N2 O3 Pd
Calculated formula	C29 H30 Cr N2 O3 Pd
Title of publication	Stabilization of an Electron-Unsaturated Pd(I)‒Pd(I) Unit by Double Hemichelation
Authors of publication	Werlé, Christophe; Karmazin, Lydia; Bailly, Corinne; Ricard, Louis; Djukic, Jean-Pierre
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	12
Pages of publication	3055
a	29.849 ± 0.003 Å
b	12.0939 ± 0.0013 Å
c	17.43 ± 0.0018 Å
α	90°
β	114.094 ± 0.002°
γ	90°
Cell volume	5743.9 ± 1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1433
Residual factor for significantly intense reflections	0.0708
Weighted residual factors for significantly intense reflections	0.1091
Weighted residual factors for all reflections included in the refinement	0.1277
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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