Crystallography Open Database

Information card for entry 7001557

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Coordinates	7001557.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H46 O8 Sb2
Calculated formula	C50 H46 O8 Sb2
Title of publication	Synthesis of bismuth and antimony complexes of the “larger” calix[n]arenes (n = 6‒8); from mononuclear to tetranuclear complexes
Authors of publication	Mendoza-Espinosa, Daniel; Rheingold, Arnold L.; Hanna, Tracy A.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	26
Pages of publication	5226 - 5238
a	13.122 ± 0.007 Å
b	13.766 ± 0.008 Å
c	14.418 ± 0.008 Å
α	94.09 ± 0.01°
β	115.115 ± 0.008°
γ	114.994 ± 0.008°
Cell volume	2035 ± 2 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0477
Residual factor for significantly intense reflections	0.0343
Weighted residual factors for significantly intense reflections	0.084
Weighted residual factors for all reflections included in the refinement	0.0892
Goodness-of-fit parameter for all reflections included in the refinement	0.952
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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