Crystallography Open Database

Information card for entry 7713098

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Coordinates	7713098.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H70 Cu2 N4
Calculated formula	C72 H70 Cu2 N4
Title of publication	New copper(I) complexes of bulky 5-substituted-2-iminopyrrolyl ligands as catalysts for azide-alkyne cycloaddition
Authors of publication	Gomes, Pedro T.; Cruz, Tiago Carpinteiro; Lopes, Patrícia S.; Lemos, Maria Amélia N. D. A.; Veiros, Luis F.
Journal of publication	Dalton Transactions
Year of publication	2023
a	12.766 ± 0.002 Å
b	13.503 ± 0.003 Å
c	20.234 ± 0.003 Å
α	83.795 ± 0.008°
β	87.004 ± 0.008°
γ	73.954 ± 0.005°
Cell volume	3331.5 ± 1 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 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	0.1448
Residual factor for significantly intense reflections	0.1083
Weighted residual factors for significantly intense reflections	0.2981
Weighted residual factors for all reflections included in the refinement	0.3243
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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