Crystallography Open Database

Information card for entry 7135038

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Coordinates	7135038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H37 N O
Calculated formula	C36 H37 N O
Title of publication	Mechanochemically controllable synthesis of mono- or di-alkenylated indolizines.
Authors of publication	Yu, Yue; Guan, Ning; Zhao, Chunying; Cao, Hua; Ma, Yan-Long
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	86
Pages of publication	16834 - 16837
a	9.7987 ± 0.001 Å
b	20.5217 ± 0.0016 Å
c	28.652 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5761.5 ± 1 Å³
Cell temperature	149.99 ± 0.1 K
Ambient diffraction temperature	149.99 ± 0.1 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1279
Residual factor for significantly intense reflections	0.0831
Weighted residual factors for significantly intense reflections	0.15
Weighted residual factors for all reflections included in the refinement	0.17
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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