Crystallography Open Database

Information card for entry 4134833

Preview

Coordinates	4134833.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H86 Cr4 N2 Si4
Calculated formula	C48 H86 Cr4 N2 Si4
Title of publication	Dinitrogen Activation and Hydrogenation by C<sub>5</sub>Me<sub>4</sub>SiMe<sub>3</sub>-Ligated Di- and Trinuclear Chromium Hydride Complexes.
Authors of publication	Shima, Takanori; Yang, Jimin; Luo, Gen; Luo, Yi; Hou, Zhaomin
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	28.9967 ± 0.0011 Å
b	11.1756 ± 0.0004 Å
c	32.7459 ± 0.0013 Å
α	90°
β	94.35 ± 0.001°
γ	90°
Cell volume	10580.9 ± 0.7 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0604
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.0793
Weighted residual factors for all reflections included in the refinement	0.0897
Goodness-of-fit parameter for all reflections included in the refinement	1.0511
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4134833.html