Crystallography Open Database

Information card for entry 4087945

Preview

Coordinates	4087945.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H62 Ge2 O Si7
Calculated formula	C27 H62 Ge2 O Si7
SMILES	C(=O)(c1c(cc(cc1C)C)C)[Ge]1([Si](C)(C)[Si](C)(C)[Ge]([Si](C)(C)[Si]1(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
Title of publication	Stable Germenolates and Germenes with Exocyclic Structures
Authors of publication	Haas, Michael; Leypold, Mario; Schnalzer, Dominik; Torvisco, Ana; Stueger, Harald
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	21
Pages of publication	5291
a	18.786 ± 0.003 Å
b	9.4192 ± 0.0012 Å
c	24.162 ± 0.003 Å
α	90°
β	107.504 ± 0.006°
γ	90°
Cell volume	4077.5 ± 1 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0407
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0533
Weighted residual factors for all reflections included in the refinement	0.0576
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
237152 (current)	2019-11-24	cif/ Adding structures of 4087945, 4087946, 4087947, 4087948, 4087949, 4087950 via cif-deposit CGI script.	4087945.cif