Crystallography Open Database

Information card for entry 4348144

Preview

Coordinates	4348144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H24 Cl5 F6 N7 P Re S
Calculated formula	C38 H24 Cl5 F6 N7 P Re S
Title of publication	Luminescent Rhenium(I) Pyridyldiaminocarbene Complexes: Photophysics, Anion-Binding, and CO2-Capturing Properties.
Authors of publication	Ng, Chi-On; Cheng, Shun-Cheung; Chu, Wing-Kin; Tang, Kin-Man; Yiu, Shek-Man; Ko, Chi-Chiu
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	16
Pages of publication	7969 - 7979
a	11.6465 ± 0.0011 Å
b	12.4634 ± 0.0012 Å
c	17.4211 ± 0.0015 Å
α	97.016 ± 0.008°
β	104.947 ± 0.008°
γ	105.707 ± 0.009°
Cell volume	2301.3 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0861
Residual factor for significantly intense reflections	0.0649
Weighted residual factors for significantly intense reflections	0.1669
Weighted residual factors for all reflections included in the refinement	0.1823
Goodness-of-fit parameter for all reflections included in the refinement	1.143
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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