Crystallography Open Database

Information card for entry 7159652

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Coordinates	7159652.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H50 Br2 N6 O8
Calculated formula	C32 H24 Br N3 O4
Title of publication	Spirocyclization and Michael addition of 3-benzylidene succinimides: route to spirocyclopentapyrrolidine-tetraones and benzylidene <i>N</i>-arylpyrrolidine-diones.
Authors of publication	Dahiya, Pooja; Yadav, Anoop; Peddinti, Rama Krishna
Journal of publication	Organic & biomolecular chemistry
Year of publication	2023
Journal volume	21
Journal issue	46
Pages of publication	9192 - 9199
a	12.8 ± 0.14 Å
b	12.93 ± 0.15 Å
c	18.3 ± 0.2 Å
α	101.19 ± 0.14°
β	94.84 ± 0.15°
γ	107.4 ± 0.2°
Cell volume	2802 ± 5 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2491
Residual factor for significantly intense reflections	0.0795
Weighted residual factors for significantly intense reflections	0.1751
Weighted residual factors for all reflections included in the refinement	0.2825
Goodness-of-fit parameter for all reflections included in the refinement	1.0067
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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