Crystallography Open Database

Information card for entry 7714730

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Coordinates	7714730.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H28 N2 Ni O2
Calculated formula	C23 H28 N2 Ni O2
Title of publication	Half-sandwich Ni(II) complexes bearing enantiopure bidentate NHC-carboxylate ligands: efficient catalysts for the hydrosilylative reduction of acetophenones.
Authors of publication	Sanz-Garrido, Jorge; Martin, Avelino; González-Arellano, Camino; Flores, Juan C.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	4
Pages of publication	1460 - 1468
a	9.4289 ± 0.0005 Å
b	13.1499 ± 0.0006 Å
c	17.094 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	2119.47 ± 0.19 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0575
Residual factor for significantly intense reflections	0.0424
Weighted residual factors for significantly intense reflections	0.0999
Weighted residual factors for all reflections included in the refinement	0.1097
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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