Crystallography Open Database

Information card for entry 4134570

Preview

Coordinates	4134570.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30.67 H26.67 Cu4 I4 N6 O0.67 P2
Calculated formula	C30.6666 H26.6664 Cu4 I4 N6 O0.6666 P2
Title of publication	Ultrafast Luminescent Light-Up Guest Detection Based on the Lock of the Host Molecular Vibration.
Authors of publication	Liu, Chun-Yu; Chen, Xu-Ran; Chen, Hui-Xian; Niu, Zheng; Hirao, Hajime; Braunstein, Pierre; Lang, Jian-Ping
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	30.4981 ± 0.0011 Å
b	30.4981 ± 0.0011 Å
c	11.5146 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	9275.2 ± 0.6 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0727
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.0866
Weighted residual factors for all reflections included in the refinement	0.1128
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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