Crystallography Open Database

Information card for entry 7059365

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Coordinates	7059365.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H24 Br2 N4 Se2 Zn
Calculated formula	C14 H24 Br2 N4 Se2 Zn
Title of publication	Homoleptic and heteroleptic Zn(ii) selone catalysts for thioetherification of aryl halides without scrubbing oxygen
Authors of publication	Vaddamanu, Moulali; Velappan, Kavitha; Prabusankar, Ganesan
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	9
Pages of publication	3574 - 3583
a	14.3427 ± 0.0006 Å
b	14.0781 ± 0.0005 Å
c	21.6645 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	4374.5 ± 0.3 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1694
Residual factor for significantly intense reflections	0.1307
Weighted residual factors for significantly intense reflections	0.3611
Weighted residual factors for all reflections included in the refinement	0.4641
Goodness-of-fit parameter for all reflections included in the refinement	1.6618
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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