Crystallography Open Database

Information card for entry 7134962

Preview

Coordinates	7134962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H53 Cl2 O4 Si3
Calculated formula	C53 H53 Cl2 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	16.5351 ± 0.0006 Å
b	15.4526 ± 0.0005 Å
c	19.1218 ± 0.0007 Å
α	90°
β	102.301 ± 0.007°
γ	90°
Cell volume	4773.6 ± 0.3 Å³
Cell temperature	153.15 K
Ambient diffraction temperature	153.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0576
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for significantly intense reflections	0.1039
Weighted residual factors for all reflections included in the refinement	0.1076
Goodness-of-fit parameter for all reflections included in the refinement	1.143
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7134962.html