Crystallography Open Database

Information card for entry 7156618

Preview

Coordinates	7156618.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H16 N2 O2
Calculated formula	C21 H16 N2 O2
Title of publication	Platinum(ii)-catalyzed selective para C-H alkoxylation of arylamines through a coordinating activation strategy.
Authors of publication	Shen, Jiabin; Xu, Jun; Cai, Heng; Shen, Chao; Zhang, Pengfei
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	3
Pages of publication	490 - 497
a	6.1601 ± 0.0007 Å
b	16.0224 ± 0.0018 Å
c	16.6437 ± 0.0019 Å
α	90°
β	99.193 ± 0.002°
γ	90°
Cell volume	1621.6 ± 0.3 Å³
Cell temperature	273.15 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	4
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	0.0662
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.1025
Weighted residual factors for all reflections included in the refinement	0.1175
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
225303 (current)	2019-11-08	cif/ Updating files of 7156618 Original log message: Adding full bibliography for 7156618.cif.	7156618.cif
212605	2018-12-15	cif/ Adding structures of 7156618 via cif-deposit CGI script.	7156618.cif