Crystallography Open Database

Information card for entry 7716326

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Coordinates	7716326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H24 Al N O6 S
Calculated formula	C20 H24 Al N O6 S
Title of publication	Solvent vapour-responsive structural transformations in molecular crystals composed of a luminescent mononuclear aluminium(III) complex.
Authors of publication	Kobayashi, Fumiya; Yoshida, Azuki; Gemba, Misato; Takatsu, Yuta; Tadokoro, Makoto
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	28
Pages of publication	11689 - 11696
a	13.6042 ± 0.0018 Å
b	8.4261 ± 0.0011 Å
c	17.987 ± 0.002 Å
α	90°
β	94.771 ± 0.005°
γ	90°
Cell volume	2054.7 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 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	0.1184
Residual factor for significantly intense reflections	0.0984
Weighted residual factors for significantly intense reflections	0.2526
Weighted residual factors for all reflections included in the refinement	0.2692
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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