Crystallography Open Database

Information card for entry 4116890

Preview

Coordinates	4116890.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C294 H208 B4 Cl20 F80 N8 O8 P8 Rh4
Calculated formula	C294 H208 B4 Cl20 F80 N8 O8 P8 Rh4
Title of publication	Strategy for Preparing Molecular Cylinders with Synthetically Programmable Structural Parameters
Authors of publication	Joshua R. Farrell; Chad A. Mirkin; Louise M. Liable-Sands; Arnold L. Rheingold
Journal of publication	Journal of the American Chemical Society
Year of publication	1998
Journal volume	120
Pages of publication	11834 - 11835
a	17.127 ± 0.0002 Å
b	20.3437 ± 0.0004 Å
c	24.4755 ± 0.0004 Å
α	82.6712 ± 0.0004°
β	86.6043 ± 0.0012°
γ	81.0029 ± 0.0009°
Cell volume	8347.5 ± 0.2 Å³
Cell temperature	198 ± 2 K
Ambient diffraction temperature	198 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2309
Residual factor for significantly intense reflections	0.09
Weighted residual factors for significantly intense reflections	0.2185
Weighted residual factors for all reflections included in the refinement	0.2706
Goodness-of-fit parameter for all reflections included in the refinement	0.966
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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