Crystallography Open Database

Information card for entry 4022157

Preview

Coordinates	4022157.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42.375 H68.75 Cl0.75 I2 P4 Pt2
Calculated formula	C42.375 H68.75 Cl0.75 I2 P4 Pt2
Title of publication	The Synthesis of New 60° Organometallic Subunits and Self-Assembly of Three-Dimensional M~3~L~2~ Trigonal-Bipyramidal Cages
Authors of publication	Hai-Bo Yang; Koushik Ghosh; Atta M. Arif; Peter J. Stang
Journal of publication	Journal of Organic Chemistry
Year of publication	2006
Journal volume	71
Pages of publication	9464 - 9469
a	17.3448 ± 0.0002 Å
b	22.291 ± 0.0003 Å
c	25.7311 ± 0.0002 Å
α	90°
β	92.7173 ± 0.0008°
γ	90°
Cell volume	9937.3 ± 0.19 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1191
Residual factor for significantly intense reflections	0.0599
Weighted residual factors for significantly intense reflections	0.1348
Weighted residual factors for all reflections included in the refinement	0.1788
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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