Crystallography Open Database

Information card for entry 7717315

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Coordinates	7717315.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H60 Co2 N4 O8
Calculated formula	C56 H60 Co2 N4 O8
Title of publication	Phase-dependent polymerization isomerism in the coordination complexes of a flexible bis(β-diketonato) ligand
Authors of publication	Imperato, Manuel; Nicolini, Alessio; Boniburini, Matteo; Gómez-Coca, Silvia; Ruiz, Eliseo; Santanni, Fabio; Sorace, Lorenzo; Cornia, Andrea
Journal of publication	Dalton Transactions
Year of publication	2024
a	8.1332 ± 0.0003 Å
b	12.4868 ± 0.0005 Å
c	14.157 ± 0.0005 Å
α	104.594 ± 0.0013°
β	92.0834 ± 0.0012°
γ	107.165 ± 0.0012°
Cell volume	1319.83 ± 0.09 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0355
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0743
Weighted residual factors for all reflections included in the refinement	0.0791
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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