Crystallography Open Database

Information card for entry 7714910

Preview

Coordinates	7714910.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H40 Cl2 N10 Ni
Calculated formula	C33 H40 Cl2 N10 Ni
Title of publication	A mesoionic carbene stabilized nickel(II) hydroxide complex: a facile precursor for C-H activation chemistry.
Authors of publication	Pavun, Anna; Niess, Raffael; Scheibel, Lucas A.; Seidl, Michael; Hohloch, Stephan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	6
Pages of publication	2749 - 2761
a	7.7265 ± 0.0016 Å
b	13.252 ± 0.002 Å
c	16.223 ± 0.003 Å
α	77.721 ± 0.007°
β	85.348 ± 0.007°
γ	79.973 ± 0.007°
Cell volume	1596.6 ± 0.5 Å³
Cell temperature	103 K
Ambient diffraction temperature	103 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0782
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.109
Weighted residual factors for all reflections included in the refinement	0.1116
Goodness-of-fit parameter for all reflections included in the refinement	1.228
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7714910.html