Crystallography Open Database

Information card for entry 7005737

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Coordinates	7005737.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H42 B Cl2 N Ru
Calculated formula	C28 H42 B Cl2 N Ru
Title of publication	Synthesis, structure and coordination of the ambiphilic ligand (2-picolyl)BCy2
Authors of publication	Jérôme Vergnaud; Tahra Ayed; Khansaa Hussein; Laure Vendier; Mary Grellier; Ghenwa Bouhadir; Jean-Claude Barthelat; Sylviane Sabo-Etienne; Didier Bourissou
Journal of publication	Dalton Transactions
Year of publication	2007
Journal issue	23
Pages of publication	2370
a	12.454 ± 0.0011 Å
b	13.3645 ± 0.0016 Å
c	17.766 ± 0.002 Å
α	86.727 ± 0.01°
β	71.861 ± 0.009°
γ	86.425 ± 0.009°
Cell volume	2802.4 ± 0.5 Å³
Cell temperature	180 K
Ambient diffraction temperature	180 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	0.1292
Residual factor for significantly intense reflections	0.0663
Weighted residual factors for significantly intense reflections	0.1613
Weighted residual factors for all reflections included in the refinement	0.1768
Goodness-of-fit parameter for all reflections included in the refinement	0.882
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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