Crystallography Open Database

Information card for entry 4085775

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Coordinates	4085775.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C228 H212 N2 Sm2
Calculated formula	C228 H212 N2 Sm2
Title of publication	Base-Free Lanthanoidocenes(II) Coordinated by Bulky Pentabenzylcyclopentadienyl Ligands
Authors of publication	Selikhov, Alexander N.; Mahrova, Tatyana V.; Cherkasov, Anton V.; Fukin, Georgy K.; Larionova, Joulia; Long, Jêrome; Trifonov, Alexander A.
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	10
Pages of publication	1991
a	12.4064 ± 0.00009 Å
b	16.75168 ± 0.00011 Å
c	20.8507 ± 0.00013 Å
α	92.6919 ± 0.0005°
β	93.9369 ± 0.0005°
γ	93.7052 ± 0.0006°
Cell volume	4308.34 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0477
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0984
Weighted residual factors for all reflections included in the refinement	0.1018
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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