Crystallography Open Database

Information card for entry 7058378

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Coordinates	7058378.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H15 N2 O2 P Se
Calculated formula	C18 H15 N2 O2 P Se
Title of publication	Alkali metal complex-mediated ring-opening polymerization of rac-LA, ε-caprolactone, and δ-valerolactone
Authors of publication	Harinath, Adimulam; Bhattacharjee, Jayeeta; Sarkar, Alok; Panda, Tarun K.
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	23
Pages of publication	8882
a	27.298 ± 0.003 Å
b	9.3728 ± 0.0005 Å
c	16.0877 ± 0.0015 Å
α	90°
β	122.05 ± 0.013°
γ	90°
Cell volume	3488.8 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.048
Residual factor for significantly intense reflections	0.0385
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1056
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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