Crystallography Open Database

Information card for entry 7250003

Preview

Coordinates	7250003.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H40 B Cu F4 N6 O P2
Calculated formula	C46 H40 B Cu F4 N6 O P2
Title of publication	Synthesis, characterization, and green to orange luminescence properties of copper(i) complexes with 3-bdppmapy ligand-containing phenanthroline and its derivatives
Authors of publication	Mou, Wen-Long; Fan, Si-Jie; Wang, Ying-Long; Wang, Guo; Hu, Fu-Zhen; Guo, Gui-Xiong; Han, Hong-Liang; Xin, Xiu-Lan; Liu, Jian-Ming; Yang, Yu-Ping; Li, Zhong-Feng; Jin, Qiong-Hua
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	14
Pages of publication	2086 - 2100
a	11.9345 ± 0.0011 Å
b	13.5182 ± 0.0012 Å
c	13.6237 ± 0.0012 Å
α	85.59 ± 0.003°
β	82.487 ± 0.002°
γ	88.594 ± 0.004°
Cell volume	2172.4 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0923
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1367
Weighted residual factors for all reflections included in the refinement	0.156
Goodness-of-fit parameter for all reflections included in the refinement	0.961
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
298856 (current)	2025-04-05	cif/ Updating files of 7250002, 7250003, 7250004, 7250005, 7250006, 7250007, 7250008, 7250009 Original log message: Adding full bibliography for 7250002--7250009.cif.	7250003.cif
297813	2025-02-21	cif/ Adding structures of 7250002, 7250003, 7250004, 7250005, 7250006, 7250007, 7250008, 7250009 via cif-deposit CGI script.	7250003.cif