Crystallography Open Database

Information card for entry 7708589

Preview

Coordinates	7708589.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H36 Br8 Cl Ge N O4
Calculated formula	C28 H36 Br8 Cl Ge N O4
SMILES	[Ge]12(Cl)(Oc3c(O1)c(c(c(c3Br)Br)Br)Br)Oc1c(O2)c(c(c(c1Br)Br)Br)Br.[N+](CCCC)(CCCC)(CCCC)CCCC
Title of publication	Assessing the Lewis Acidity and Catalytic Activity of Bis(catecholato)germanes
Authors of publication	Henry, Andrew Timothy; Cosby, Taylor P. L.; Boyle, Paul D.; Baines, Kim M.
Journal of publication	Dalton Transactions
Year of publication	2021
a	9.864 ± 0.005 Å
b	11.942 ± 0.006 Å
c	16.473 ± 0.007 Å
α	84.984 ± 0.01°
β	88.202 ± 0.008°
γ	73.534 ± 0.013°
Cell volume	1853.7 ± 1.5 Å³
Cell temperature	223 K
Ambient diffraction temperature	223 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0462
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0518
Weighted residual factors for all reflections included in the refinement	0.0571
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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