Crystallography Open Database

Information card for entry 7708303

Preview

Coordinates	7708303.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H92 Cl14 N6 O9 Si6 Zn3
Calculated formula	C73 H92 Cl14 N6 O9 Si6 Zn3
Title of publication	Dual crystalline-amorphous salen-metal complexes behave like nematic droplets with AIEgens vistas.
Authors of publication	Damoc, Madalin; Stoica, Alexandru-Constantin; Dascalu, Mihaela; Asandulesa, Mihai; Shova, Sergiu; Cazacu, Maria
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
a	15.6914 ± 0.0009 Å
b	17.4652 ± 0.0007 Å
c	19.6006 ± 0.0008 Å
α	99.587 ± 0.003°
β	104.598 ± 0.004°
γ	109.175 ± 0.004°
Cell volume	4723.6 ± 0.4 Å³
Cell temperature	180.05 ± 0.1 K
Ambient diffraction temperature	180.05 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1254
Residual factor for significantly intense reflections	0.0823
Weighted residual factors for significantly intense reflections	0.1568
Weighted residual factors for all reflections included in the refinement	0.1753
Goodness-of-fit parameter for all reflections included in the refinement	1.099
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
269191 (current)	2021-09-18	cif/ Adding structures of 7708300, 7708301, 7708302, 7708303, 7708304, 7708305 via cif-deposit CGI script.	7708303.cif