Crystallography Open Database

Information card for entry 7712840

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Coordinates	7712840.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	3b
Formula	C24 H52 Fe Si7
Calculated formula	C24 H52 Fe Si7
Title of publication	Persilylation of Ferrocene: The Ultimate Discipline in Sterically Overcrowded Metal Complexes
Authors of publication	Rupf, Susanne M.; Sievers, Robin; Riemann, Paulin S.; Reimann, Marc; Kaupp, Martin; Fasting, Dr. Carlo; Malischewski, Moritz
Journal of publication	Dalton Transactions
Year of publication	2023
a	11.1775 ± 0.0006 Å
b	12.2628 ± 0.0006 Å
c	13.4623 ± 0.0007 Å
α	79.414 ± 0.002°
β	68.618 ± 0.002°
γ	80.572 ± 0.002°
Cell volume	1679.51 ± 0.15 Å³
Cell temperature	159 K
Ambient diffraction temperature	159 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0392
Residual factor for significantly intense reflections	0.033
Weighted residual factors for significantly intense reflections	0.0873
Weighted residual factors for all reflections included in the refinement	0.0911
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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