Crystallography Open Database

Information card for entry 7708862

Preview

Coordinates	7708862.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H18 F6 Ge O3 P2 S
Calculated formula	C7 H18 F6 Ge O3 P2 S
SMILES	[Ge]([P](C)(C)C)([P](C)(C)C)(F)(F)(F)OS(=O)(=O)C(F)(F)F
Title of publication	Neutral and cationic germanium(IV) fluoride complexes with phosphine coordination – synthesis, spectroscopy and structures
Authors of publication	King, Rhys; Levason, William; Reid, Gillian
Journal of publication	Dalton Transactions
Year of publication	2021
a	11.3324 ± 0.0001 Å
b	11.7241 ± 0.0001 Å
c	23.5687 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3131.39 ± 0.06 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0265
Residual factor for significantly intense reflections	0.0207
Weighted residual factors for significantly intense reflections	0.0486
Weighted residual factors for all reflections included in the refinement	0.0502
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
270707 (current)	2021-11-17	cif/ Adding structures of 7708856, 7708857, 7708858, 7708859, 7708860, 7708861, 7708862, 7708863, 7708864, 7708865 via cif-deposit CGI script.	7708862.cif