Crystallography Open Database

Information card for entry 7133107

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Coordinates	7133107.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H25 N O
Calculated formula	C33 H25 N O
Title of publication	Expedient Access to Polysubstituted Acrylamides via Strain-Release-Driven Dual Phosphine and Palladium Catalysis
Authors of publication	Yao, Yu-Xiang; Zhang, Jing; Min, Xuehong; Qin, Lan; Yi, Wei; Gao, Yang; Hu, Xiao-Qiang
Journal of publication	Chemical Communications
Year of publication	2024
a	5.82 ± 0.003 Å
b	9.093 ± 0.004 Å
c	23.432 ± 0.012 Å
α	79.032 ± 0.012°
β	87.963 ± 0.016°
γ	78.447 ± 0.012°
Cell volume	1192.7 ± 1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.1645
Residual factor for significantly intense reflections	0.0939
Weighted residual factors for significantly intense reflections	0.2176
Weighted residual factors for all reflections included in the refinement	0.2434
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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