Crystallography Open Database

Information card for entry 7159808

Preview

Coordinates	7159808.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H38 N2 O2
Calculated formula	C46 H38 N2 O2
Title of publication	Alkene carboamination/oxidative denitrogenation of 3-allyl-3-hydrazinylindolin-2-ones: one-pot entry to spirocyclopropyloxindoles.
Authors of publication	Manenti, Marco; Villa, Tommaso; Macetti, Giovanni; Silvani, Alessandra
Journal of publication	Organic & biomolecular chemistry
Year of publication	2024
Journal volume	22
Journal issue	10
Pages of publication	2124 - 2136
a	11.543 ± 0.0006 Å
b	11.9861 ± 0.0009 Å
c	13.867 ± 0.0009 Å
α	84.966 ± 0.006°
β	76.217 ± 0.005°
γ	62.126 ± 0.006°
Cell volume	1646.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1936
Residual factor for significantly intense reflections	0.1597
Weighted residual factors for significantly intense reflections	0.4266
Weighted residual factors for all reflections included in the refinement	0.4461
Goodness-of-fit parameter for all reflections included in the refinement	1.125
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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