Crystallography Open Database

Information card for entry 4087946

Preview

Coordinates	4087946.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H58 Ge2 O Si7
Calculated formula	C25 H58 Ge2 O Si7
SMILES	C(=O)(c1ccccc1C)[Ge]1([Si](C)(C)[Si](C)(C)[Ge]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)[Si]1(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	14.0822 ± 0.0006 Å
b	16.9268 ± 0.0008 Å
c	16.8058 ± 0.0008 Å
α	90°
β	99.166 ± 0.002°
γ	90°
Cell volume	3954.8 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0638
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1641
Weighted residual factors for all reflections included in the refinement	0.1703
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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.	4087946.cif