Crystallography Open Database

Information card for entry 7134963

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Coordinates	7134963.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H50 O4 Si3
Calculated formula	C52 H50 O4 Si3
Title of publication	Synthesis and characterization of the first neutral hexacoordinated silole complexes.
Authors of publication	Szathmári, Balázs; Holczbauer, Tamás; Balterer, Bence; Domján, Attila; Volk, Balázs; Kovács, Ilona; Kelemen, Zsolt
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	82
Pages of publication	16042 - 16045
a	17.857 ± 0.0012 Å
b	11.106 ± 0.0004 Å
c	23.4549 ± 0.0014 Å
α	90°
β	91.262 ± 0.004°
γ	90°
Cell volume	4650.4 ± 0.5 Å³
Cell temperature	103.15 K
Ambient diffraction temperature	103.15 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/c 1
Hall space group symbol	-I 2yc
Residual factor for all reflections	0.0613
Residual factor for significantly intense reflections	0.05
Weighted residual factors for significantly intense reflections	0.0933
Weighted residual factors for all reflections included in the refinement	0.0973
Goodness-of-fit parameter for all reflections included in the refinement	1.213
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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