Crystallography Open Database

Information card for entry 7050585

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Coordinates	7050585.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H28 Br4 Cl4 O4
Calculated formula	C33 H28 Br4 Cl4 O4
Title of publication	Biaryl cross-coupling reactions: convenient routes to new functionalized calix[8]arenes
Authors of publication	Baudry, Roselyne; Felix, Caroline; Bavoux, Claude; Perrin, Monique; Vocanson, Francis; Dumazet-Bonnamour, Isabelle; Lamartine, Roger
Journal of publication	New Journal of Chemistry
Year of publication	2003
Journal volume	27
Journal issue	10
Pages of publication	1540
a	27.894 ± 0.006 Å
b	14.665 ± 0.003 Å
c	21.659 ± 0.004 Å
α	90°
β	126.01 ± 0.03°
γ	90°
Cell volume	7167 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1806
Residual factor for significantly intense reflections	0.074
Weighted residual factors for significantly intense reflections	0.147
Weighted residual factors for all reflections included in the refinement	0.2033
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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