Crystallography Open Database

Information card for entry 7234730

Preview

Coordinates	7234730.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H35 Ir N6 O4
Calculated formula	C47 H35 Ir N6 O4
Title of publication	A facile color-tuning strategy for constructing a library of Ir(iii) complexes with fine-tuned phosphorescence from bluish green to red using a synergetic substituent effect of -OCH3 and -CN at only the C-ring of C/Ν ligand
Authors of publication	Yan Jiao; Ming Li; Ning Wang; Tao Lu; Liang Zhou; Yan Huang; Zhiyun Lu; Daibing Luo; Xuemei Pu
Journal of publication	Journal of Materials Chemistry C
Year of publication	2016
Journal volume	4
Pages of publication	4269 - 4277
a	13.1742 ± 0.0003 Å
b	13.1742 ± 0.0003 Å
c	28.3375 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	4918.2 ± 0.2 Å³
Cell temperature	143.05 ± 0.1 K
Ambient diffraction temperature	143.05 ± 0.1 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.064
Residual factor for significantly intense reflections	0.0597
Weighted residual factors for significantly intense reflections	0.1261
Weighted residual factors for all reflections included in the refinement	0.1279
Goodness-of-fit parameter for all reflections included in the refinement	1.173
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
219426 (current)	2019-10-18	cif/ Adding structures of 7234727, 7234728, 7234729, 7234730 via cif-deposit CGI script.	7234730.cif