Crystallography Open Database

Information card for entry 7716199

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Coordinates	7716199.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H80 N Na Ni O9 P2
Calculated formula	C56 H80 N Na Ni O9 P2
Title of publication	Reactivity of Low-valent Nickel Carbonyl Species Supported by Acridane Based PNP Ligands towards Iodoalkanes
Authors of publication	Park, Sanha; Mi Sook, Seo; Kim, Mingi; Lee, Kang Mun; Graham, Peter M.; Lee, Yunho
Journal of publication	Dalton Transactions
Year of publication	2024
a	16.1142 ± 0.0009 Å
b	20.8043 ± 0.001 Å
c	20.6341 ± 0.0011 Å
α	90°
β	96.543 ± 0.002°
γ	90°
Cell volume	6872.4 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1394
Residual factor for significantly intense reflections	0.0762
Weighted residual factors for significantly intense reflections	0.1683
Weighted residual factors for all reflections included in the refinement	0.1947
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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