Crystallography Open Database

Information card for entry 7035704

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Coordinates	7035704.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H43 F12 N9 P2 Pd
Calculated formula	C38 H43 F12 N9 P2 Pd
Title of publication	Synthesis of a flexible macrocyclic tetraimidazolium salt-precursor for a tetracarbene ligand with metal dependent coordination modes.
Authors of publication	Schulte To Brinke, Christian; Ekkehardt Hahn, F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	32
Pages of publication	14315 - 14322
a	12.0953 ± 0.0005 Å
b	12.4132 ± 0.0005 Å
c	15.6467 ± 0.0007 Å
α	92.87 ± 0.001°
β	99.637 ± 0.001°
γ	112.997 ± 0.001°
Cell volume	2114.67 ± 0.16 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0492
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.1026
Weighted residual factors for all reflections included in the refinement	0.108
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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