Crystallography Open Database

Information card for entry 1572865

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Coordinates	1572865.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H32 N2 O4 Sn2
Calculated formula	C44 H32 N2 O4 Sn2
Title of publication	Quadrupolar dinuclear hypervalent tin(iv) compounds with near-infrared emission consisting of Schiff bases based on π-conjugated scaffolds
Authors of publication	Tanimura, Kazuya; Tanaka, Kento; Gon, Masayuki; Tanaka, Kazuo
Journal of publication	Chemical Science
Year of publication	2024
a	9.383 ± 0.008 Å
b	12.3335 ± 0.001 Å
c	16.264 ± 0.014 Å
α	80.34 ± 0.02°
β	84.76 ± 0.03°
γ	82.51 ± 0.03°
Cell volume	1835 ± 2 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1365
Residual factor for significantly intense reflections	0.0887
Weighted residual factors for significantly intense reflections	0.1647
Weighted residual factors for all reflections included in the refinement	0.1981
Goodness-of-fit parameter for all reflections included in the refinement	1.083
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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