Crystallography Open Database

Information card for entry 4517655

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Coordinates	4517655.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H34 Cl4 O4 P2 Se4
Calculated formula	C32 H34 Cl4 O4 P2 Se4
Title of publication	Novel Five- and Six-Membered Rings of Phosphorus-Selenium Heterocycles from Selenation of Amido-Schiff Bases.
Authors of publication	Hua, Guoxiong; Cordes, David B.; Slawin, Alexandra M. Z.; Woollins, J. Derek
Journal of publication	ACS omega
Year of publication	2020
Journal volume	5
Journal issue	20
Pages of publication	11737 - 11744
a	9.3324 ± 0.0013 Å
b	9.3983 ± 0.0007 Å
c	12.8393 ± 0.0014 Å
α	70.724 ± 0.011°
β	88.5 ± 0.014°
γ	64.524 ± 0.008°
Cell volume	950.7 ± 0.2 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0259
Residual factor for significantly intense reflections	0.0221
Weighted residual factors for significantly intense reflections	0.0567
Weighted residual factors for all reflections included in the refinement	0.0576
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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