Crystallography Open Database

Information card for entry 7705270

Preview

Coordinates	7705270.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[Co6Se8(Ph2PNHiPr)6][PF6]
Formula	C90 H108 Co6 F6 N6 P7 Se8
Calculated formula	C90 H108 Co6 F6 N6 P7 Se8
Title of publication	Inorganic clusters as metalloligands: ligand effects on the synthesis and properties of ternary nanopropeller clusters.
Authors of publication	Kephart, Jonathan A.; Boggiano, Andrew C.; Kaminsky, Werner; Velian, Alexandra
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	45
Pages of publication	16464 - 16473
a	14.2628 ± 0.0008 Å
b	14.2802 ± 0.0009 Å
c	15.0757 ± 0.0009 Å
α	112.912 ± 0.003°
β	112.532 ± 0.003°
γ	99.092 ± 0.003°
Cell volume	2436.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0713
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0786
Weighted residual factors for all reflections included in the refinement	0.0861
Goodness-of-fit parameter for all reflections included in the refinement	0.993
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
260793 (current)	2021-01-07	cif/ Updating files of 7705267, 7705268, 7705269, 7705270, 7705271, 7705272, 7705273 Original log message: Adding full bibliography for 7705267--7705273.cif.	7705270.cif
255647	2020-08-26	cif/ Adding structures of 7705267, 7705268, 7705269, 7705270, 7705271, 7705272, 7705273 via cif-deposit CGI script.	7705270.cif