Crystallography Open Database

Information card for entry 4510460

Preview

Coordinates	4510460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H25 N O5 S
Calculated formula	C24 H23 N O5 S
Title of publication	Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Authors of publication	Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	5
Pages of publication	2381
a	31.3213 ± 0.0013 Å
b	31.3213 ± 0.0013 Å
c	13.0094 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	11052.7 ± 0.8 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0913
Residual factor for significantly intense reflections	0.0592
Weighted residual factors for significantly intense reflections	0.1393
Weighted residual factors for all reflections included in the refinement	0.1537
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
179651 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/04.	4510460.cif
115648	2014-06-05	cif/ Updating files of 4510452, 4510453, 4510454, 4510455, 4510456, 4510457, 4510458, 4510459, 4510460, 4510461, 4510462 Original log message: Adding full bibliography for 4510452--4510462.cif.	4510460.cif
109958	2014-04-18	cif/ Adding structures of 4510452, 4510453, 4510454, 4510455, 4510456, 4510457, 4510458, 4510459, 4510460, 4510461, 4510462 via cif-deposit CGI script.	4510460.cif