Crystallography Open Database

Information card for entry 7115679

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Coordinates	7115679.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H25 As Cl F3 O4 S
Calculated formula	C32 H25 As Cl F3 O4 S
Title of publication	Multicomponent reactions involving phosphines, arynes and aldehydes
Authors of publication	Anup Bhunia; Trinadh Kaicharla; Digvijay Porwal; Rajesh G. Gonnade; Akkattu T. Biju
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	11389
a	9.6419 ± 0.0002 Å
b	14.7407 ± 0.0004 Å
c	20.9802 ± 0.0005 Å
α	90°
β	91.849 ± 0.001°
γ	90°
Cell volume	2980.33 ± 0.12 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0735
Residual factor for significantly intense reflections	0.0547
Weighted residual factors for significantly intense reflections	0.1273
Weighted residual factors for all reflections included in the refinement	0.1385
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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