Crystallography Open Database

Information card for entry 7123562

Preview

Coordinates	7123562.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H19 F N2
Calculated formula	C29 H19 F N2
Title of publication	Cascade intramolecular imidoylation and C−H activation/annulat-ion of benzimidoyl chlorides with alkynes: one-pot synthesis of 7H-dibenzo[de,h]quinoline analogues
Authors of publication	Liu, Jiao; Fang, Hao; Cheng, Rui; Wang, Zhishuo; Yang, Yudong; You, Jingsong
Journal of publication	Chemical Communications
Year of publication	2019
a	7.3391 ± 0.0004 Å
b	10.1719 ± 0.0005 Å
c	13.947 ± 0.0011 Å
α	79.927 ± 0.005°
β	88.333 ± 0.006°
γ	84.415 ± 0.005°
Cell volume	1020.19 ± 0.11 Å³
Cell temperature	293.52 ± 0.1 K
Ambient diffraction temperature	293.52 ± 0.1 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	0.0677
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.1599
Weighted residual factors for all reflections included in the refinement	0.1792
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
215592 (current)	2019-05-30	cif/ Adding structures of 7123561, 7123562, 7123563, 7123564, 7123565, 7123566, 7123567 via cif-deposit CGI script.	7123562.cif