Crystallography Open Database

Information card for entry 7248148

Preview

Coordinates	7248148.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H24 N11 O15 Y Zn
Calculated formula	C36 H24 N11 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	17.8105 ± 0.0005 Å
b	12.4596 ± 0.0005 Å
c	19.4286 ± 0.0006 Å
α	90°
β	110.544 ± 0.001°
γ	90°
Cell volume	4037.2 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0827
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.0683
Weighted residual factors for all reflections included in the refinement	0.0765
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248148.html