Crystallography Open Database

Information card for entry 1572213

Preview

Coordinates	1572213.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H48 Ge N2 Si2
Calculated formula	C25 H48 Ge N2 Si2
SMILES	[Ge]1(C(=C(C(=C1[Si](C)(C)C(C)(C)C)C)C)[Si](C)(C)C(C)(C)C)=C1N(C(=C(N1C)C)C)C
Title of publication	Phospha-bicyclohexene-germylenes exhibiting unexpected reactivity.
Authors of publication	Würdemann, Marie Sophie; Kühn, Steffen; Bötel, Tobias; Schmidtmann, Marc; Müller, Thomas
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	35
Pages of publication	14161 - 14170
a	11.0704 ± 0.0003 Å
b	12.4659 ± 0.0003 Å
c	21.05 ± 0.0006 Å
α	90°
β	101.041 ± 0.0011°
γ	90°
Cell volume	2851.18 ± 0.13 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0268
Residual factor for significantly intense reflections	0.0209
Weighted residual factors for significantly intense reflections	0.0548
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
295192 (current)	2024-10-06	cif/ Updating files of 1572207, 1572208, 1572209, 1572210, 1572211, 1572212, 1572213 Original log message: Adding full bibliography for 1572207--1572213.cif.	1572213.cif
293598	2024-07-31	cif/ Adding structures of 1572207, 1572208, 1572209, 1572210, 1572211, 1572212, 1572213 via cif-deposit CGI script.	1572213.cif