Crystallography Open Database

Information card for entry 7062279

Preview

Coordinates	7062279.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H32 N4 O3
Calculated formula	C43 H32 N4 O3
Title of publication	Selective construction of polycyclic cyclohepta[b]indoles and cyclopenta[b]indoles via cycloaddition reaction of 3-(indol-3-yl)maleimides and (indol-2-yl)methanols
Authors of publication	Sun, Jing; Yan, Chen; Sun, Qiu; Han, Ying; Yan, Chao-Guo
Journal of publication	New Journal of Chemistry
Year of publication	2023
Journal volume	47
Journal issue	14
Pages of publication	6694 - 6699
a	29.965 ± 0.006 Å
b	10.1561 ± 0.0019 Å
c	27.43 ± 0.006 Å
α	90°
β	101.793 ± 0.006°
γ	90°
Cell volume	8172 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1579
Residual factor for significantly intense reflections	0.1073
Weighted residual factors for significantly intense reflections	0.3132
Weighted residual factors for all reflections included in the refinement	0.3406
Goodness-of-fit parameter for all reflections included in the refinement	0.98
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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