Crystallography Open Database

Information card for entry 7062175

Preview

Coordinates	7062175.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H90 Br10.94 Cl7.06 Mn3 N6
Calculated formula	C36 H90 Br10.944 Cl7.056 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	23.6709 ± 0.0012 Å
b	9.4002 ± 0.0004 Å
c	15.9372 ± 0.0007 Å
α	90°
β	91.605 ± 0.004°
γ	90°
Cell volume	3544.8 ± 0.3 Å³
Cell temperature	374.98 ± 0.1 K
Ambient diffraction temperature	374.98 ± 0.1 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	0.1551
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1443
Weighted residual factors for all reflections included in the refinement	0.1791
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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

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