Crystallography Open Database

Information card for entry 7131577

Preview

Coordinates	7131577.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H28 N2 O2
Calculated formula	C30 H28 N2 O2
Title of publication	Azofuran activation for annulative rearrangement enabled by gold(I)/Brønsted acid relay catalysis.
Authors of publication	Rao, Qian; Zhang, Yin; Liu, Yin-Ping; Jiang, Bo; Wang, Xiang; Tu, Shu-Jiang; Hao, Wen-Juan
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2023
Journal volume	59
Journal issue	38
Pages of publication	5725 - 5728
a	13.824 ± 0.003 Å
b	19.701 ± 0.005 Å
c	9.478 ± 0.002 Å
α	90°
β	101.577 ± 0.004°
γ	90°
Cell volume	2528.8 ± 1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
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	0.0945
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1489
Weighted residual factors for all reflections included in the refinement	0.1719
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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