Crystallography Open Database

Information card for entry 7716327

Preview

Coordinates	7716327.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H21 Al N2 O5
Calculated formula	C20 H21 Al N2 O5
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	20.2047 ± 0.0013 Å
b	8.4969 ± 0.0006 Å
c	22.9627 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	3942.2 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1391
Residual factor for significantly intense reflections	0.0655
Weighted residual factors for significantly intense reflections	0.1523
Weighted residual factors for all reflections included in the refinement	0.2035
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7716327.html