Crystallography Open Database

Information card for entry 7251866

Preview

Coordinates	7251866.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H72 Cu2 N8 O24 P4
Calculated formula	C38 H72 Cu2 N8 O24 P4
Title of publication	Dipyridinophane ligands – synthesis and coordination study
Authors of publication	Kuncová, Lucie; Lazarová, Jana; Kotek, Jan; Kubíček, Vojtěch; Hermann, Petr
Journal of publication	RSC Advances
Year of publication	2026
Journal volume	16
Journal issue	20
Pages of publication	18220 - 18231
a	11.0889 ± 0.0006 Å
b	11.3906 ± 0.0006 Å
c	11.9217 ± 0.0006 Å
α	94.577 ± 0.002°
β	102.408 ± 0.002°
γ	110.001 ± 0.002°
Cell volume	1362.53 ± 0.13 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.0231
Residual factor for significantly intense reflections	0.0228
Weighted residual factors for significantly intense reflections	0.0616
Weighted residual factors for all reflections included in the refinement	0.0618
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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