Crystallography Open Database

Information card for entry 4330157

Preview

Coordinates	4330157.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94.5 H79.5 Cl7.5 Lu N12
Calculated formula	C94.5 H79.5 Cl7.5 Lu N12
Title of publication	Constructing Sandwich-Type Rare Earth Double-Decker Complexes with N-Confused Porphyrinato and Phthalocyaninato Ligands
Authors of publication	Wei Cao; Hailong Wang; Xin Wang; Hung Kay Lee; Dennis K. P. Ng; Jianzhuang Jiang
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9265 - 9272
a	31.3137 ± 0.0006 Å
b	17.2088 ± 0.0003 Å
c	31.6031 ± 0.0007 Å
α	90°
β	101.807 ± 0.002°
γ	90°
Cell volume	16669.7 ± 0.6 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0961
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1491
Weighted residual factors for all reflections included in the refinement	0.1634
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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