Crystallography Open Database

Information card for entry 7157101

Preview

Coordinates	7157101.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H18 Br N O2
Calculated formula	C32 H18 Br N O2
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	12.5801 ± 0.0011 Å
b	29.118 ± 0.002 Å
c	7.2563 ± 0.0007 Å
α	90°
β	98.229 ± 0.003°
γ	90°
Cell volume	2630.7 ± 0.4 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1867
Residual factor for significantly intense reflections	0.0784
Weighted residual factors for significantly intense reflections	0.1713
Weighted residual factors for all reflections included in the refinement	0.2118
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	No
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.	7157101.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.	7157101.cif