Crystallography Open Database

Information card for entry 7721134

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Coordinates	7721134.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H69 B N2 Sr
Calculated formula	C53 H61 B N2 Sr
Title of publication	A Strontium Alumanyl
Authors of publication	Hill, Michael; Pearce, Kyle; Liu, Han-Ying; McMullin, Claire Louise
Journal of publication	Dalton Transactions
Year of publication	2026
a	16.2127 ± 0.0001 Å
b	24.2898 ± 0.0001 Å
c	25.956 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	10221.6 ± 0.11 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 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	0.0336
Residual factor for significantly intense reflections	0.0289
Weighted residual factors for significantly intense reflections	0.0708
Weighted residual factors for all reflections included in the refinement	0.0732
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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