Crystallography Open Database

Information card for entry 7705273

Preview

Coordinates	7705273.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Zn3Co6Se8(Ph2PNiPr)6
Formula	C90 H102.68 Co6 N6 P6 Se8 Zn2.66
Calculated formula	C90 H102.675 Co6 N6 P6 Se8 Zn2.6625
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	18.8172 ± 0.0015 Å
b	22.3972 ± 0.0016 Å
c	25.035 ± 0.002 Å
α	90°
β	92.286 ± 0.004°
γ	90°
Cell volume	10542.7 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	7
Hermann-Mauguin space group symbol	P 1 n 1
Hall space group symbol	P -2yac
Residual factor for all reflections	0.0656
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0786
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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.	7705273.cif
255647	2020-08-26	cif/ Adding structures of 7705267, 7705268, 7705269, 7705270, 7705271, 7705272, 7705273 via cif-deposit CGI script.	7705273.cif