Crystallography Open Database

Information card for entry 4078049

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Coordinates	4078049.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H54 Cl2 N4 Si4 Ti
Calculated formula	C30 H54 Cl2 N4 Si4 Ti
Title of publication	Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates
Authors of publication	Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	8
Pages of publication	3435
a	28.489 ± 0.0005 Å
b	8.804 ± 0.0003 Å
c	20.185 ± 0.0005 Å
α	90°
β	128.743 ± 0.0014°
γ	90°
Cell volume	3948.7 ± 0.2 Å³
Cell temperature	230 ± 0.1 K
Ambient diffraction temperature	230 ± 0.1 K
Number of distinct elements	6
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	0.0488
Residual factor for significantly intense reflections	0.0325
Weighted residual factors for significantly intense reflections	0.0849
Weighted residual factors for all reflections included in the refinement	0.0884
Goodness-of-fit parameter for all reflections included in the refinement	0.95
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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