Crystallography Open Database

Information card for entry 7031928

7031927 << 7031928 >> 7031929

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Coordinates	7031928.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H120 Li4 O24 Ti2
Calculated formula	C102 H120 Li4 O24 Ti2
Title of publication	Terpenols as substituents for the diastereoselective formation of enantiomerically pure triple lithium-bridged helicate type-coordination compounds.
Authors of publication	Albrecht, M.; Isaak, E.; Shigemitsu, H.; Moha, V.; Raabe, G.; Fröhlich, R
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	39
Pages of publication	14636 - 14643
a	36.798 ± 0.0004 Å
b	36.798 ± 0.0004 Å
c	32.7961 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	38459.3 ± 0.8 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.1756
Residual factor for significantly intense reflections	0.1281
Weighted residual factors for significantly intense reflections	0.3106
Weighted residual factors for all reflections included in the refinement	0.3416
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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