Crystallography Open Database

Information card for entry 4316193

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Coordinates	4316193.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H66 N2 O4 Ti
Calculated formula	C44 H66 N2 O4 Ti
Title of publication	Group 4 Salalen Complexes and Their Application for the Ring-Opening Polymerization of rac-Lactide
Authors of publication	Emma L. Whitelaw; Matthew D. Jones; Mary F. Mahon
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	7176 - 7181
a	24.059 ± 0.0003 Å
b	18.036 ± 0.0003 Å
c	20.087 ± 0.0003 Å
α	90°
β	102.74 ± 0.001°
γ	90°
Cell volume	8501.7 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 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	0.0587
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.093
Weighted residual factors for all reflections included in the refinement	0.103
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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