Crystallography Open Database

Information card for entry 7113747

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Coordinates	7113747.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H77 B F24 Ni P2
Calculated formula	C73 H72 B F24 Ni P2
Title of publication	New thermally stable cationic η3-allyl(1,4-diphospha-(1,3)-butadiene)nickel complexes for ethylene polymerization
Authors of publication	Ionkin, Alex; Marshall, William
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2003
Journal issue	6
Pages of publication	710 - 711
a	14.2861 ± 0.0011 Å
b	18.4281 ± 0.0015 Å
c	27.872 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	7337.7 ± 1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1372
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.128
Weighted residual factors for all reflections included in the refinement	0.1667
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7104009
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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