Crystallography Open Database

Information card for entry 4083962

Preview

Coordinates	4083962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H86 Fe2 N8 O5 Ru2
Calculated formula	C92 H85 Fe2 N8 O5 Ru2
Title of publication	Selective Ligand Modification on the Periphery of Diruthenium Compounds: Toward New Metal-Alkynyl Scaffolds
Authors of publication	Chen, Wei-Zhong; Ren, Tong
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	11
Pages of publication	2660 - 2669
a	22.1088 ± 0.0009 Å
b	17.002 ± 0.0007 Å
c	22.1884 ± 0.0009 Å
α	90°
β	93.66 ± 0.001°
γ	90°
Cell volume	8323.5 ± 0.6 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.087
Residual factor for significantly intense reflections	0.0496
Weighted residual factors for significantly intense reflections	0.1224
Weighted residual factors for all reflections included in the refinement	0.1399
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	4060530
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/4083962.html