Crystallography Open Database

Information card for entry 7157103

Preview

Coordinates	7157103.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H52 Cl2 N2 O8
Calculated formula	C73 H52 Cl2 N2 O8
Title of publication	Construction of indeno[1,2-a]fluorene via domino reaction of 1,3-indanedione and 3-arylideneindolin-2-ones or chalcones.
Authors of publication	Cao, Jun; Sun, Jing; Yan, Chao-Guo
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	40
Pages of publication	9008 - 9013
a	11.4707 ± 0.0009 Å
b	17.0265 ± 0.0014 Å
c	17.1384 ± 0.0016 Å
α	68.014 ± 0.003°
β	87.526 ± 0.003°
γ	70.835 ± 0.002°
Cell volume	2919.6 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.244
Residual factor for significantly intense reflections	0.1287
Weighted residual factors for significantly intense reflections	0.3281
Weighted residual factors for all reflections included in the refinement	0.3991
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
225193 (current)	2019-11-08	cif/ Updating files of 7157095, 7157096, 7157097, 7157098, 7157099, 7157100, 7157101, 7157102, 7157103, 7157104, 7157105, 7157106 Original log message: Adding full bibliography for 7157095--7157106.cif.	7157103.cif
218658	2019-09-21	cif/ Adding structures of 7157095, 7157096, 7157097, 7157098, 7157099, 7157100, 7157101, 7157102, 7157103, 7157104, 7157105, 7157106 via cif-deposit CGI script.	7157103.cif