Crystallography Open Database

Information card for entry 4033437

Preview

Coordinates	4033437.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H18 F6 O2
Calculated formula	C32 H18 F6 O2
Title of publication	Stereoselective Photodimerization of 3-Arylindenones in Solution and in the Solid State.
Authors of publication	Uemura, Naohiro; Ishikawa, Hiroki; Tamura, Naoki; Yoshida, Yasushi; Mino, Takashi; Kasashima, Yoshio; Sakamoto, Masami
Journal of publication	The Journal of organic chemistry
Year of publication	2018
Journal volume	83
Journal issue	4
Pages of publication	2256 - 2262
a	9.0161 ± 0.0009 Å
b	9.3663 ± 0.001 Å
c	16.0999 ± 0.0016 Å
α	77.857 ± 0.001°
β	85.231 ± 0.001°
γ	69.991 ± 0.001°
Cell volume	1248.9 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0526
Weighted residual factors for significantly intense reflections	0.1385
Weighted residual factors for all reflections included in the refinement	0.1631
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
227530 (current)	2019-11-12	cif/ Updating files of 4033434, 4033435, 4033436, 4033437, 4033438, 4033439, 4033440, 4033441, 4033442, 4033443, 4033444, 4033445, 4033446 Original log message: Adding full bibliography for 4033434--4033446.cif.	4033437.cif
205669	2018-01-26	cif/ Adding structures of 4033437 via cif-deposit CGI script.	4033437.cif