Crystallography Open Database

Information card for entry 7010766

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Coordinates	7010766.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H12 F3 N4 O6 Re S2
Calculated formula	C20 H12 F3 N4 O6 Re S2
Title of publication	Luminescent rhenium(i) polypyridine complexes with an isothiocyanate moiety‒versatile labelling reagents for biomolecules
Authors of publication	Kam-Wing Lo, Kenneth; Chun-Ming Ng, Dominic; Hui, Wai-Ki; Cheung, Kung-Kai
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	18
Pages of publication	2634
a	11.572 ± 0.001 Å
b	15.864 ± 0.001 Å
c	13.054 ± 0.001 Å
α	90°
β	91.508 ± 0.007°
γ	90°
Cell volume	2395.6 ± 0.3 Å³
Cell temperature	301.2 K
Ambient diffraction temperature	301.2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0355
Weighted residual factors for significantly intense reflections	0.0537
Goodness-of-fit parameter for significantly intense reflections	2.205
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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