Crystallography Open Database

Information card for entry 7233867

Preview

Coordinates	7233867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H14 Br N3 O2
Calculated formula	C10 H14 Br N3 O2
Title of publication	Weak intermolecular interactions promote blue luminescence of protonated 2,2'-dipyridylamine salts
Authors of publication	Alexander N. Chernyshev; Dmitry Morozov; Jarkko Mutanen; Vadim Yu Kukushkin; Gerrit Groenhof; Matti Haukka
Journal of publication	Journal of Materials Chemistry C
Year of publication	2014
Journal volume	2
Pages of publication	8285 - 8294
a	9.5861 ± 0.0002 Å
b	16.1448 ± 0.0003 Å
c	8.18095 ± 0.00016 Å
α	90°
β	107.024 ± 0.002°
γ	90°
Cell volume	1210.65 ± 0.04 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0424
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0936
Weighted residual factors for all reflections included in the refinement	0.0974
Goodness-of-fit parameter for all reflections included in the refinement	1.109
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7233867.html