Crystallography Open Database

Information card for entry 4118420

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Coordinates	4118420.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H55 Cl2 In N2 O2
Calculated formula	C31 H55 Cl2 In N2 O2
Title of publication	Mechanism of Living Lactide Polymerization by Dinuclear Indium Catalysts and Its Impact on Isoselectivity
Authors of publication	Insun Yu; Alberto Acosta-Ramírez; Parisa Mehrkhodavandi
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	12758 - 12773
a	13.1666 ± 0.0007 Å
b	26.4092 ± 0.0016 Å
c	10.3219 ± 0.0006 Å
α	90°
β	111.782 ± 0.004°
γ	90°
Cell volume	3332.9 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	7
Hermann-Mauguin space group symbol	P 1 c 1
Hall space group symbol	P -2yc
Residual factor for all reflections	0.0992
Residual factor for significantly intense reflections	0.0701
Weighted residual factors for significantly intense reflections	0.177
Weighted residual factors for all reflections included in the refinement	0.1991
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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