Crystallography Open Database

Information card for entry 1569771

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Coordinates	1569771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H22 Cl2 Cu N2 Se2
Calculated formula	C24 H22 Cl2 Cu N2 Se2
Title of publication	Chalcogen bonding in copper(II)-mediated synthesis.
Authors of publication	Aliyeva, Vusala A.; Gurbanov, Atash V.; Mahmoud, Abdallah G.; Gomila, Rosa M.; Frontera, Antonio; Mahmudov, Kamran T.; Pombeiro, Armando J. L.
Journal of publication	Faraday discussions
Year of publication	2023
Journal volume	244
Journal issue	0
Pages of publication	77 - 95
a	9.533 ± 0.0003 Å
b	10.8335 ± 0.0003 Å
c	12.517 ± 0.0004 Å
α	77.904 ± 0.001°
β	73.264 ± 0.001°
γ	73.894 ± 0.001°
Cell volume	1177.49 ± 0.06 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0614
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.0853
Weighted residual factors for all reflections included in the refinement	0.0959
Goodness-of-fit parameter for all reflections included in the refinement	1.215
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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