Crystallography Open Database

Information card for entry 4307825

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Coordinates	4307825.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H102 O6 P2 Zr
Calculated formula	C72 H102 O6 P2 Zr
Title of publication	Biphenolate Phosphine Complexes of Group 4 Metals
Authors of publication	Lan-Chang Liang; Yu-Ning Chang; Hon Man Lee
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	2666 - 2673
a	13.0543 ± 0.0009 Å
b	15.8 ± 0.0011 Å
c	19.508 ± 0.002 Å
α	108.855 ± 0.007°
β	104.769 ± 0.007°
γ	97.517 ± 0.005°
Cell volume	3580.6 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.185
Residual factor for significantly intense reflections	0.0896
Weighted residual factors for significantly intense reflections	0.2157
Weighted residual factors for all reflections included in the refinement	0.2679
Goodness-of-fit parameter for all reflections included in the refinement	0.932
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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