Crystallography Open Database

Information card for entry 7000381

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Structure parameters

Formula	C42 H64 Ge O7
Calculated formula	C42 H64 Ge O7
Title of publication	[(OtBu)2C6H3]3Ge+ a free germyl cation with aryl ligands
Authors of publication	Schenk, Christian; Drost, Christian; Schnepf, Andreas
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	5
Pages of publication	773 - 776
a	11.869 ± 0.002 Å
b	12.774 ± 0.003 Å
c	13.757 ± 0.003 Å
α	90.7 ± 0.03°
β	95.43 ± 0.03°
γ	90.95 ± 0.03°
Cell volume	2075.9 ± 0.8 Å³
Cell temperature	149 ± 2 K
Ambient diffraction temperature	149 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0475
Weighted residual factors for significantly intense reflections	0.1076
Weighted residual factors for all reflections included in the refinement	0.1179
Goodness-of-fit parameter for all reflections included in the refinement	0.947
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
301846 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/00/ Each referenced PubChem compound corresponds to the full crystal structure.	7000381.cif
179681	2016-03-24	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/03.	7000381.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7000381.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7000381.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7000381.cif