Crystallography Open Database

Information card for entry 7129735

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Coordinates	7129735.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H19 N O
Calculated formula	C20 H19 N O
Title of publication	Visible-light mediated intramolecular radical cyclizations of α-brominated amide-tethered alkylidenecyclopropanes
Authors of publication	Mao, Ben; Zhang, Xiao-Yu; Wei, Yin; Shi, Min
Journal of publication	Chemical Communications
Year of publication	2022
a	9.2952 ± 0.0003 Å
b	15.1908 ± 0.0006 Å
c	21.6017 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	3050.19 ± 0.19 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0447
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0909
Weighted residual factors for all reflections included in the refinement	0.097
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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