Crystallography Open Database

Information card for entry 7062174

Preview

Coordinates	7062174.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H90 Br10.76 Cl7.24 Mn3 N6
Calculated formula	C36 H90 Br10.76 Cl7.24 Mn3 N6
Title of publication	Dual dielectric-responsive hybrid materials with fluorescent properties
Authors of publication	Xu, Ran; Lun, Meng-Meng; Zhang, Tie; Li, Jie; Zou, Ke; Zhang, Yi; Fu, Da-Wei; Guo, Qiang
Journal of publication	New Journal of Chemistry
Year of publication	2023
Journal volume	47
Journal issue	5
Pages of publication	2405 - 2411
a	23.5235 ± 0.0008 Å
b	9.3471 ± 0.0003 Å
c	15.7733 ± 0.0005 Å
α	90°
β	91.648 ± 0.003°
γ	90°
Cell volume	3466.7 ± 0.2 Å³
Cell temperature	282 ± 3 K
Ambient diffraction temperature	282 ± 3 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.087
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0856
Weighted residual factors for all reflections included in the refinement	0.0979
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
281515 (current)	2023-03-04	cif/ Updating files of 7062174, 7062175 Original log message: Adding full bibliography for 7062174--7062175.cif.	7062174.cif
279960	2022-12-21	cif/ Adding structures of 7062174, 7062175 via cif-deposit CGI script.	7062174.cif