Crystallography Open Database

Information card for entry 4133992

Preview

Coordinates	4133992.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C597 H884 B16 Cl30 F64 N82 O66 Pt24 S24
Calculated formula	C597 H884 B16 Cl30 F64 N82 O66 Pt24 S24
Title of publication	Self-Assembly, Structural Transformation and Guest-Binding Properties of Supramolecular Assemblies with Triangular Metal-Metal Bonded Units.
Authors of publication	Wang, Li-Juan; Li, Xin; Bai, Sha; Wang, Yaoyu; Han, Ying-Feng
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	28.704 ± 0.009 Å
b	38.089 ± 0.013 Å
c	18.042 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	19725 ± 11 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	179.99 K
Number of distinct elements	9
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0537
Residual factor for significantly intense reflections	0.0399
Weighted residual factors for significantly intense reflections	0.0957
Weighted residual factors for all reflections included in the refinement	0.1018
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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