Crystallography Open Database

Information card for entry 7717026

Preview

Coordinates	7717026.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C86 H84 B F24 N4 Ni
Calculated formula	C86 H84 B F24 N4 Ni
Title of publication	Analogous carbene-stabilised [M<sup>I</sup>-(η<sup>6</sup>-tol)]<sup>+</sup> cations (M = Fe, Co, Ni): synthetic access and [carbene·M<sup>I</sup>]<sup>+</sup> transfer.
Authors of publication	Schulz, Annika; Hadlington, Terrance J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	38
Pages of publication	15795 - 15800
a	16.69 ± 0.003 Å
b	28.58 ± 0.006 Å
c	17.9 ± 0.004 Å
α	90°
β	90.4 ± 0.03°
γ	90°
Cell volume	8538 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.138
Residual factor for significantly intense reflections	0.0718
Weighted residual factors for significantly intense reflections	0.1942
Weighted residual factors for all reflections included in the refinement	0.2316
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
295278 (current)	2024-10-06	cif/ Updating files of 7717023, 7717024, 7717025, 7717026, 7717027, 7717028 Original log message: Adding full bibliography for 7717023--7717028.cif.	7717026.cif
294802	2024-09-20	cif/ Adding structures of 7717023, 7717024, 7717025, 7717026, 7717027, 7717028 via cif-deposit CGI script.	7717026.cif