Crystallography Open Database

Information card for entry 7715985

Preview

Coordinates	7715985.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[Cp*Fe(?5-1,2,3-P3C2tBu2)]
Formula	C20 H33 Fe P3
Calculated formula	C20 H33 Fe P3
Title of publication	Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Authors of publication	Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Journal of publication	Dalton Transactions
Year of publication	2024
a	10.1779 ± 0.0002 Å
b	12.7916 ± 0.0002 Å
c	16.426 ± 0.0002 Å
α	90°
β	107.87 ± 0.002°
γ	90°
Cell volume	2035.35 ± 0.06 Å³
Cell temperature	122.97 ± 0.16 K
Ambient diffraction temperature	122.97 ± 0.16 K
Number of distinct elements	4
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	0.0298
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.0772
Weighted residual factors for all reflections included in the refinement	0.0783
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7715985.html