Crystallography Open Database

Information card for entry 7716680

Preview

Coordinates	7716680.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H63 Cl Cu D6 N5
Calculated formula	C57 H63 Cl Cu D6 N5
Title of publication	Group 11 complexes of a bulky triazene ligand.
Authors of publication	George, Tanner; Grant, Tamika; Munhoz, Isadora Schumann; Do, Thai; Masuda, Jason D.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	31
Pages of publication	13107 - 13118
a	10.6515 ± 0.0003 Å
b	19.6951 ± 0.0005 Å
c	24.8627 ± 0.0007 Å
α	90°
β	99.271 ± 0.001°
γ	90°
Cell volume	5147.6 ± 0.2 Å³
Cell temperature	125 K
Ambient diffraction temperature	125 K
Number of distinct elements	6
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	0.062
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.1223
Weighted residual factors for all reflections included in the refinement	0.1413
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
294570 (current)	2024-09-06	cif/ Updating files of 7716674, 7716675, 7716676, 7716677, 7716678, 7716679, 7716680, 7716681, 7716682 Original log message: Adding full bibliography for 7716674--7716682.cif.	7716680.cif
293478	2024-07-20	cif/ Adding structures of 7716674, 7716675, 7716676, 7716677, 7716678, 7716679, 7716680, 7716681, 7716682 via cif-deposit CGI script.	7716680.cif