Crystallography Open Database

Information card for entry 7716885

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Coordinates	7716885.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H40 Co N4 O4
Calculated formula	C44 H40 Co N4 O4
Title of publication	Coordination compounds of cobalt(II) with carboxylate non–steroidal anti–inflammatory drugs: Structure and biological profile
Authors of publication	Perontsis, Spyros; Hatzidimitriou, Antonios; Psomas, George L.
Journal of publication	Dalton Transactions
Year of publication	2024
a	9.4414 ± 0.0008 Å
b	12.2235 ± 0.0013 Å
c	17.5565 ± 0.0018 Å
α	102.832 ± 0.006°
β	97.905 ± 0.005°
γ	107.314 ± 0.005°
Cell volume	1840.3 ± 0.3 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 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	0.0708
Residual factor for significantly intense reflections	0.0419
Weighted residual factors for all reflections	0.0668
Weighted residual factors for significantly intense reflections	0.0551
Weighted residual factors for all reflections included in the refinement	0.0551
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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