Crystallography Open Database

Information card for entry 4110493

Preview

Coordinates	4110493.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H36 B2 F8 N4 Pd2
Calculated formula	C22 H36 B2 F8.5 N4 Pd2
Title of publication	Stereoretentive Elimination and Trans-olefination of the Dicationic Dipalladium Moiety [Pd2Ln]2+ Bound on 1,3,5-Trienes
Authors of publication	Tetsuro Murahashi; Hiromitsu Nakashima; Tomoki Nagai; Yukari Mino; Taketoshi Okuno; M. Abdul Jalil; Hideo Kurosawa
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	4377 - 4388
a	17.2416 ± 0.0003 Å
b	12.1588 ± 0.0003 Å
c	29.5145 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	6187.3 ± 0.2 Å³
Cell temperature	277.2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for all reflections included in the refinement	0.0401
Goodness-of-fit parameter for all reflections included in the refinement	0.048
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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