Crystallography Open Database

Information card for entry 7234395

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Structure parameters

Formula	C32 H24 N4
Calculated formula	C32 H24 N4
Title of publication	Multi-stimuli responsive properties switch by intra- and inter-molecular charge transfer constructed from triphenylamine derivative
Authors of publication	Hu, Wangqin; Yang, Wen; Gong, Tingfeng; Zhou, Weiqun; Zhang, Yuhan
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	43
Pages of publication	6630
a	12.4552 ± 0.0012 Å
b	14.2434 ± 0.0014 Å
c	13.5827 ± 0.0013 Å
α	90°
β	101.738 ± 0.003°
γ	90°
Cell volume	2359.2 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	3
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	0.0789
Residual factor for significantly intense reflections	0.0587
Weighted residual factors for significantly intense reflections	0.156
Weighted residual factors for all reflections included in the refinement	0.1731
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
301866 (current)	2025-08-23	Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure.	7234395.cif
223534	2019-11-07	cif/ Updating files of 7234395 Original log message: Adding full bibliography for 7234395.cif.	7234395.cif
219102	2019-10-05	cif/ Adding structures of 7234395 via cif-deposit CGI script.	7234395.cif