Crystallography Open Database

Information card for entry 4323103

Preview

Coordinates	4323103.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H44 N4 O12 Re4 S4
Calculated formula	C44 H30 N4 O12 Re4 S4
Title of publication	Synthesis and Characterization of Molecular Rectangles Based upon Rhenium Thiolate Dimers
Authors of publication	Kurt D. Benkstein; Joseph T. Hupp; Charlotte L. Stern
Journal of publication	Inorganic Chemistry
Year of publication	1998
Journal volume	37
Pages of publication	5404 - 5405
a	9.332 ± 0.003 Å
b	17.644 ± 0.004 Å
c	15.695 ± 0.003 Å
α	90°
β	92.92 ± 0.02°
γ	90°
Cell volume	2580.9 ± 1.1 Å³
Cell temperature	153.2 K
Ambient diffraction temperature	153.2 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 significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.0328
Goodness-of-fit parameter for significantly intense reflections	1.646
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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