Crystallography Open Database

Information card for entry 4079097

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Coordinates	4079097.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64.67 H58 N5.33 Ni O2 P2
Calculated formula	C64.6667 H58 N5.33333 Ni O2 P2
Title of publication	“Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms
Authors of publication	Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	17
Pages of publication	6162
a	11.73863 ± 0.0001 Å
b	11.70932 ± 0.00011 Å
c	58.7106 ± 0.0005 Å
α	90°
β	92.4392 ± 0.0009°
γ	90°
Cell volume	8062.54 ± 0.12 Å³
Cell temperature	160 ± 1 K
Ambient diffraction temperature	160 ± 1 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0626
Residual factor for significantly intense reflections	0.0593
Weighted residual factors for significantly intense reflections	0.1186
Weighted residual factors for all reflections included in the refinement	0.1199
Goodness-of-fit parameter for all reflections included in the refinement	1.198
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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