Crystallography Open Database

Information card for entry 7025169

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Coordinates	7025169.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94 H98 N8 Ni
Calculated formula	C94 H98 N8 Ni
Title of publication	Highly preorganized pyrazolate-bridged palladium(II) and nickel(II) complexes in bimetallic norbornene polymerization.
Authors of publication	Sachse, Anna; Demeshko, Serhiy; Dechert, Sebastian; Daebel, Venita; Lange, Adam; Meyer, Franc
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	16
Pages of publication	3903 - 3914
a	9.792 ± 0.0006 Å
b	14.766 ± 0.0009 Å
c	27.84 ± 0.0016 Å
α	83.335 ± 0.005°
β	80.671 ± 0.005°
γ	86.048 ± 0.005°
Cell volume	3940.1 ± 0.4 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.194
Residual factor for significantly intense reflections	0.0729
Weighted residual factors for significantly intense reflections	0.1203
Weighted residual factors for all reflections included in the refinement	0.1565
Goodness-of-fit parameter for all reflections included in the refinement	0.871
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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