Crystallography Open Database

Information card for entry 4116760

Preview

Coordinates	4116760.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H13 B Cl2 N7 O Os
Calculated formula	C10.5 H11.5 B Cl2.01 N6.99 O0.99 Os
Title of publication	Chalcogen Atom Transfer to a Metal Nitrido. The First Transition Metal Selenonitrosyl Complex
Authors of publication	Thomas J. Crevier; Scott Lovell; James M. Mayer; Arnold L. Rheingold; Ilia A. Guzei
Journal of publication	Journal of the American Chemical Society
Year of publication	1998
Journal volume	120
Pages of publication	6607 - 6608
a	11.3735 ± 0.0002 Å
b	11.3735 ± 0.0002 Å
c	7.7134 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	864.1 ± 0.03 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	7
Space group number	147
Hermann-Mauguin space group symbol	P -3
Hall space group symbol	-P 3
Residual factor for all reflections	0.0465
Residual factor for significantly intense reflections	0.042
Weighted residual factors for all reflections	0.1403
Weighted residual factors for significantly intense reflections	0.1218
Goodness-of-fit parameter for all reflections	1.164
Goodness-of-fit parameter for significantly intense reflections	1.047
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/4116760.html