Crystallography Open Database

Information card for entry 7133666

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Coordinates	7133666.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H29 N O6
Calculated formula	C28 H29 N O6
Title of publication	Phosphine-catalyzed enantioselective and diastereodivergent [3+2] cyclization for the construction of oxetane dispirooxindole skeletons.
Authors of publication	Han, Xiao; Hou, Jie; Zhang, Haiyan; Wang, Zhen; Yao, Weijun
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	77
Pages of publication	10736 - 10739
a	8.9244 ± 0.0003 Å
b	10.4924 ± 0.0003 Å
c	13.3388 ± 0.0004 Å
α	90°
β	90.992 ± 0.001°
γ	90°
Cell volume	1248.84 ± 0.07 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.028
Residual factor for significantly intense reflections	0.0279
Weighted residual factors for significantly intense reflections	0.0947
Weighted residual factors for all reflections included in the refinement	0.0949
Goodness-of-fit parameter for all reflections included in the refinement	0.924
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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