Crystallography Open Database

Information card for entry 7248156

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Coordinates	7248156.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H33 N14 O15 Y Zn
Calculated formula	C42 H33 N14 O15 Y Zn
Title of publication	Union is strength: π–π stacking interactions are capable of preventing solid-state racemization of tris-chelate complexes
Authors of publication	Gavrikov, Andrey V.; Ilyukhin, Andrey B.
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	12
Pages of publication	1677 - 1682
a	12.7677 ± 0.0007 Å
b	17.414 ± 0.0008 Å
c	21.6944 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	4823.5 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0671
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.0766
Weighted residual factors for all reflections included in the refinement	0.0878
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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