Crystallography Open Database

Information card for entry 7123577

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Coordinates	7123577.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H24 O5
Calculated formula	C29 H24 O5
Title of publication	Construction of polycyclic bridged indene derivatives by a tandem 1,3-rearrangement/intramolecular Friedel-Crafts cyclization of propargyl acetates
Authors of publication	Zhu, Shifa; Zhang, Jiantao; Liao, Zhehui; Chen, Lianfen; Jiang, Huanfeng
Journal of publication	Chemical Communications
Year of publication	2019
a	10.1019 ± 0.001 Å
b	10.2418 ± 0.0011 Å
c	11.659 ± 0.0011 Å
α	68.442 ± 0.01°
β	84.392 ± 0.008°
γ	87.479 ± 0.008°
Cell volume	1116.5 ± 0.2 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0923
Residual factor for significantly intense reflections	0.0721
Weighted residual factors for significantly intense reflections	0.1811
Weighted residual factors for all reflections included in the refinement	0.2026
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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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