Crystallography Open Database

Information card for entry 7063085

Preview

Coordinates	7063085.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H76 Cu3 N2 O12
Calculated formula	C38 H76 Cu3 N2 O12
Title of publication	Pivalate complexes of copper(ii) with aliphatic amines as potential precursors for depositing nanomaterials from the gas phase
Authors of publication	Butrymowicz-Kubiak, A.; Luba, W.; Madajska, K.; Muzioł, T.; Szymańska, I. B.
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	14
Pages of publication	6232 - 6245
a	11.6627 ± 0.0005 Å
b	12.4671 ± 0.0006 Å
c	16.7859 ± 0.0009 Å
α	90°
β	92.366 ± 0.004°
γ	90°
Cell volume	2438.6 ± 0.2 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	0.0528
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.1244
Weighted residual factors for all reflections included in the refinement	0.1275
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
291017 (current)	2024-04-05	cif/ Updating files of 7063085, 7063086, 7063087, 7063088 Original log message: Adding full bibliography for 7063085--7063088.cif.	7063085.cif
290528	2024-03-19	cif/ Adding structures of 7063085, 7063086, 7063087, 7063088 via cif-deposit CGI script.	7063085.cif