Crystallography Open Database

Information card for entry 4315393

Preview

Coordinates	4315393.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C169 H313 B10 Cl18 F40 P15 Pd15
Calculated formula	C168.87 H312.74 B10 Cl17.74 F40 P15 Pd15
Title of publication	Effect of Pnictogen Ligand Substitution on a Tripalladium Ditropylium Core
Authors of publication	Dominic C. Babbini; Frank L. Mulligan; Hannah R. Schulhauser; Tara C. Sweigart; Gary S. Nichol; Stephanie K. Hurst
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	4307 - 4312
a	15.047 ± 0.006 Å
b	17.647 ± 0.007 Å
c	43.937 ± 0.017 Å
α	84.523 ± 0.005°
β	81.124 ± 0.005°
γ	88.128 ± 0.005°
Cell volume	11473 ± 8 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1682
Residual factor for significantly intense reflections	0.1061
Weighted residual factors for significantly intense reflections	0.2657
Weighted residual factors for all reflections included in the refinement	0.3207
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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