Crystallography Open Database

Information card for entry 7248204

Preview

Coordinates	7248204.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H15 Cl2 N3 Zn
Calculated formula	C22 H15 Cl2 N3 Zn
Title of publication	Wavelike zinc coordination polymers: anion-modulated ligand conformation and fluorescence detection of 4-aminobenzylamine
Authors of publication	Lee, Pei-Chin; Huang, Tzu-Chiao; Wu, Jing-Yun
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	13
Pages of publication	1819 - 1828
a	11.7879 ± 0.0006 Å
b	15.0748 ± 0.0009 Å
c	11.0619 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	1965.7 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0565
Residual factor for significantly intense reflections	0.0428
Weighted residual factors for significantly intense reflections	0.1152
Weighted residual factors for all reflections included in the refinement	0.1356
Goodness-of-fit parameter for all reflections included in the refinement	1.11
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
290886 (current)	2024-04-05	cif/ Updating files of 7248204, 7248205 Original log message: Adding full bibliography for 7248204--7248205.cif.	7248204.cif
289916	2024-02-22	cif/ Adding structures of 7248204, 7248205 via cif-deposit CGI script.	7248204.cif