Crystallography Open Database

Information card for entry 7060725

Preview

Coordinates	7060725.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H35 Ge N O
Calculated formula	C24 H35 Ge N O
SMILES	[Ge]1N(c2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)C12CC3CC(C1)CC(C2)C3
Title of publication	O,N-HETEROCYCLIC GERMYLENES AS EFFICIENT CATALYSTS FOR HYDROBORATION AND CYANOSILYLATION OF BENZALDEHYDE
Authors of publication	Arsenyeva, Kseniya Vital'evna; Pashanova, Kira Igorevna; Trofimova, Olesya Yur'evna; Ershova, Irina V.; Chegerev, Maxim G.; Starikova, Alyona A.; Cherkasov, Anton Vladimirovich; Syroeshkin, Mikhail A.; Kozmenkova, Anna Ya.; Piskunov, Alexandr Vladimirovich
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	26
Pages of publication	11758 - 11767
a	10.4557 ± 0.0003 Å
b	15.3711 ± 0.0004 Å
c	13.4947 ± 0.0003 Å
α	90°
β	92.266 ± 0.001°
γ	90°
Cell volume	2167.11 ± 0.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0291
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0701
Weighted residual factors for all reflections included in the refinement	0.0709
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
301442 (current)	2025-08-04	Updating journal pages, volumes and years from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	7060725.cif
266389	2021-06-11	cif/ Adding structures of 7060725 via cif-deposit CGI script.	7060725.cif