Crystallography Open Database

Information card for entry 7159960

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Coordinates	7159960.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H29 N3 O3
Calculated formula	C26 H29 N3 O3
Title of publication	Ruthenium-catalyzed C-H functionalization of indoles and indolines with 7-azabenzonorbornadienes: access to aminodihydronaphthyl indoles and indolines.
Authors of publication	Chen, Jia-Zhen; Wang, Zhong-Xia
Journal of publication	Organic & biomolecular chemistry
Year of publication	2024
Journal volume	22
Journal issue	25
Pages of publication	5159 - 5169
a	24.63533 ± 0.00017 Å
b	24.63533 ± 0.00017 Å
c	20.6517 ± 0.00017 Å
α	90°
β	90°
γ	120°
Cell volume	10854.3 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0414
Residual factor for significantly intense reflections	0.0394
Weighted residual factors for significantly intense reflections	0.1081
Weighted residual factors for all reflections included in the refinement	0.1102
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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