Crystallography Open Database

Information card for entry 7132615

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Coordinates	7132615.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H34 N3 O3 P
Calculated formula	C27 H33 N2 O4 P
Title of publication	Pd(II)-Catalyzed enantioselective C-H olefination toward the synthesis of <i>P</i>-stereogenic phosphinamides.
Authors of publication	Chen, Zi-Jia; Fan, Ling-Jie; Xie, Pei-Pei; Qian, Pu-Fan; Hu, Xinquan; Zhou, Tao; Shi, Bing-Feng
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	12
Pages of publication	1623 - 1626
a	11.2201 ± 0.0006 Å
b	8.4447 ± 0.0005 Å
c	13.8792 ± 0.0009 Å
α	90°
β	98.303 ± 0.002°
γ	90°
Cell volume	1301.28 ± 0.13 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0313
Residual factor for significantly intense reflections	0.0309
Weighted residual factors for significantly intense reflections	0.0798
Weighted residual factors for all reflections included in the refinement	0.0803
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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