Crystallography Open Database

Information card for entry 7133729

Preview

Coordinates	7133729.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H47 Cu3 N6
Calculated formula	C34 H47 Cu3 N6
Title of publication	Facile interconversion of mesitylcopper into a CuMes-Cu<sub>2</sub>bis(amidinate) triangle and a tetracuprous Möbius strip.
Authors of publication	Dowling, Keri; Kruczyński, Tomasz; Dutta, Sanjay; Le, D. P. Ngan; Gozem, Samer; McMillen, Colin D.; Bhuvanesh, Nattamai; Stollenz, Michael
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	79
Pages of publication	11136 - 11139
a	8.6701 ± 0.001 Å
b	12.854 ± 0.0015 Å
c	15.977 ± 0.002 Å
α	88.712 ± 0.004°
β	86.426 ± 0.004°
γ	71.457 ± 0.004°
Cell volume	1684.8 ± 0.4 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0902
Residual factor for significantly intense reflections	0.0682
Weighted residual factors for significantly intense reflections	0.1838
Weighted residual factors for all reflections included in the refinement	0.2074
Goodness-of-fit parameter for all reflections included in the refinement	1.04
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
295141 (current)	2024-10-06	cif/ Updating files of 7133729, 7133730, 7133731 Original log message: Adding full bibliography for 7133729--7133731.cif.	7133729.cif
294765	2024-09-17	cif/ Adding structures of 7133729, 7133730, 7133731 via cif-deposit CGI script.	7133729.cif