Crystallography Open Database

Information card for entry 4022158

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Coordinates	4022158.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59.5 H79 Cl3 I2 P4 Pt2
Calculated formula	C59.5 H79 Cl3 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	42.007 ± 0.0006 Å
b	9.3291 ± 0.0002 Å
c	34.7621 ± 0.0006 Å
α	90°
β	109.387 ± 0.0008°
γ	90°
Cell volume	12850.4 ± 0.4 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0872
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1286
Weighted residual factors for all reflections included in the refinement	0.1454
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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