Crystallography Open Database

Information card for entry 7718033

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Coordinates	7718033.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H51 Cu F3 N12 O5 S
Calculated formula	C24 H51 Cu F3 N12 O5 S
Title of publication	Reactivity of copper(i) complexes supported by tripodal nitrogen-containing tetradentate ligands toward gaseous diatomic molecules, NO, CO and O2
Authors of publication	Morimoto, Yuma; Inoue, Keisuke; Itoh, Shinobu
Journal of publication	Dalton Transactions
Year of publication	2025
Journal volume	54
Journal issue	13
Pages of publication	5327 - 5333
a	11.0382 ± 0.0006 Å
b	12.5307 ± 0.0006 Å
c	12.775 ± 0.0007 Å
α	87.196 ± 0.0017°
β	86.389 ± 0.0017°
γ	86 ± 0.0014°
Cell volume	1757.43 ± 0.16 Å³
Cell temperature	143 K
Ambient diffraction temperature	143 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0377
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0854
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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