Crystallography Open Database

Information card for entry 7711868

Preview

Coordinates	7711868.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	HL
Formula	C30 H23 N3 O
Calculated formula	C30 H23 N3 O
SMILES	Oc1c(cc(c2ccncc2)cc1)/C=N/c1ccc(N(c2ccccc2)c2ccccc2)cc1
Title of publication	AIE -active TPA modified Schiff base for successive sensing of Cu<sup>2+</sup> and His <i>via</i> an on-off-on method and its application in bioimaging.
Authors of publication	Wang, Dan; Shao, Tian-Fen; Ding, Wei-Hua; Li, Shao-Jie; Yao, Qi; Cao, Wei; Wang, Zheng; Ma, Yangmin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	52
Journal issue	2
Pages of publication	434 - 443
a	15.6216 ± 0.0009 Å
b	9.9838 ± 0.0005 Å
c	16.1858 ± 0.0009 Å
α	90°
β	113.984 ± 0.002°
γ	90°
Cell volume	2306.4 ± 0.2 Å³
Cell temperature	281 K
Ambient diffraction temperature	281 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0899
Residual factor for significantly intense reflections	0.0613
Weighted residual factors for significantly intense reflections	0.1613
Weighted residual factors for all reflections included in the refinement	0.1809
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
283289 (current)	2023-05-05	cif/ Updating files of 7711868, 7711869 Original log message: Adding full bibliography for 7711868--7711869.cif.	7711868.cif
279708	2022-12-06	cif/ Adding structures of 7711868, 7711869 via cif-deposit CGI script.	7711868.cif