Crystallography Open Database

Information card for entry 7703084

Preview

Coordinates	7703084.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H29 N3 O19 S4 Zn3.5
Calculated formula	C33 H29 N3 O19 S4 Zn3.5
Title of publication	Sulfur heteroatom-based MOFs with long-lasting room-temperature phosphorescence and high photoelectric response.
Authors of publication	Yang, Xiao-Gang; Zhai, Zhi-Min; Liu, Xin-Yi; Li, Jin-Yao; Li, Fei-Fei; Ma, Lu-Fang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	3
Pages of publication	598 - 602
a	15.4577 ± 0.0009 Å
b	16.981 ± 0.0011 Å
c	19.2095 ± 0.0012 Å
α	66.763 ± 0.006°
β	66.652 ± 0.006°
γ	69.687 ± 0.005°
Cell volume	4143.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1136
Residual factor for significantly intense reflections	0.0922
Weighted residual factors for significantly intense reflections	0.2536
Weighted residual factors for all reflections included in the refinement	0.2729
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
247735 (current)	2020-02-04	cif/ Updating files of 7703084, 7703085 Original log message: Adding full bibliography for 7703084--7703085.cif.	7703084.cif
246374	2020-01-01	cif/ Adding structures of 7703084, 7703085 via cif-deposit CGI script.	7703084.cif