Crystallography Open Database

Information card for entry 7128643

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Coordinates	7128643.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H27.5 N2 O1.75
Calculated formula	C35 H26 N2 O1.75
Title of publication	Rhodium catalyzed multicomponent dehydrogenative annulation: one-step construction of isoindole derivatives.
Authors of publication	Lyu, Hairong; Quan, Yangjian; Cheng, Biao; Xie, Zuowei
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	64
Pages of publication	7930 - 7933
a	25.134 ± 0.002 Å
b	7.8986 ± 0.0006 Å
c	30.55 ± 0.002 Å
α	90°
β	91.564 ± 0.004°
γ	90°
Cell volume	6062.6 ± 0.8 Å³
Cell temperature	301 ± 2 K
Ambient diffraction temperature	301 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1289
Residual factor for significantly intense reflections	0.0826
Weighted residual factors for significantly intense reflections	0.2568
Weighted residual factors for all reflections included in the refinement	0.2952
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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