Crystallography Open Database

Information card for entry 7700297

Preview

Coordinates	7700297.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H94 Cl2 F2 N8 Si4
Calculated formula	C52 H94 Cl2 F2 N8 Si4
Title of publication	NHC-stabilized silyl-substituted silyliumylidene ions.
Authors of publication	Frisch, Philipp; Inoue, Shigeyoshi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	28
Pages of publication	10403 - 10406
a	11.0482 ± 0.0019 Å
b	17.171 ± 0.003 Å
c	21.066 ± 0.004 Å
α	66.805 ± 0.005°
β	74.978 ± 0.005°
γ	88.261 ± 0.006°
Cell volume	3536.2 ± 1.1 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0802
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.1114
Weighted residual factors for all reflections included in the refinement	0.1207
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223766 (current)	2019-11-07	cif/ Updating files of 7700296, 7700297 Original log message: Adding full bibliography for 7700296--7700297.cif.	7700297.cif
216124	2019-06-20	cif/ Adding structures of 7700296, 7700297 via cif-deposit CGI script.	7700297.cif