Crystallography Open Database

Information card for entry 7707021

Preview

Coordinates	7707021.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H98 Cl4 F12 Fe2 N6 P6 Ru
Calculated formula	C96 H98 Cl4 F12 Fe2 N6 P6 Ru
Title of publication	Tuning metal to metal charge transfer properties in cyanidometal-bridged complexes by changing the auxiliary ligand on the bridge.
Authors of publication	Xu, Qing-Dou; Zeng, Chen; Su, Shao-Dong; Yang, Yu-Ying; Hu, Sheng-Min; Li, Ting-Ya; Wu, Xin-Tao; Sheng, Tian-Lu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	18
Pages of publication	6161 - 6169
a	11.9194 ± 0.0005 Å
b	14.9993 ± 0.0005 Å
c	16.549 ± 0.0005 Å
α	106.505 ± 0.003°
β	105.512 ± 0.003°
γ	95.595 ± 0.003°
Cell volume	2684.81 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1001
Residual factor for significantly intense reflections	0.0747
Weighted residual factors for significantly intense reflections	0.196
Weighted residual factors for all reflections included in the refinement	0.2123
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
266089 (current)	2021-06-05	cif/ Updating files of 7707021, 7707022, 7707023, 7707024, 7707025, 7707026 Original log message: Adding full bibliography for 7707021--7707026.cif.	7707021.cif
263471	2021-03-31	cif/ Adding structures of 7707021, 7707022, 7707023, 7707024, 7707025, 7707026 via cif-deposit CGI script.	7707021.cif