Crystallography Open Database

Information card for entry 7712549

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Coordinates	7712549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H27 Cl3 F14 N2 P Re
Calculated formula	C47 H27 Cl3 F14 N2 P Re
Title of publication	Phenylimido Complexes of Rhenium: Fluorine Substituents Provide Protection, Reactivity and Solubility
Authors of publication	Claude, Guilhem; Kulitzki, Erika; Hagenbach, Adelheid; Roca Jungfer, Maximilian; Figueroa, Joshua S.; Abram, Ulrich
Journal of publication	Dalton Transactions
Year of publication	2023
a	46.9293 ± 0.001 Å
b	46.9293 ± 0.001 Å
c	8.3649 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	18422.5 ± 0.7 Å³
Cell temperature	105 K
Ambient diffraction temperature	105 K
Number of distinct elements	7
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0332
Residual factor for significantly intense reflections	0.0287
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0734
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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