Crystallography Open Database

Information card for entry 7705900

Preview

Coordinates	7705900.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H104 N32 O44 S6 Zn6
Calculated formula	C56 H104 N32 O44 S6 Zn6
Title of publication	Utilization of counter anions for charge transportation in the electrical device fabrication of Zn(II) metal-organic frameworks.
Authors of publication	Das, Krishna Sundar; Pal, Baishakhi; Saha, Sayan; Akhtar, Sohel; De, Avik; Ray, Partha Pratim; Mondal, Raju
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	46
Pages of publication	17005 - 17016
a	20.872 ± 0.0005 Å
b	14.6735 ± 0.0003 Å
c	17.4832 ± 0.0004 Å
α	90°
β	114.272 ± 0.001°
γ	90°
Cell volume	4881.18 ± 0.19 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0928
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.1278
Weighted residual factors for all reflections included in the refinement	0.1563
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
259702 (current)	2020-12-09	cif/ Adding structures of 7705898, 7705899, 7705900 via cif-deposit CGI script.	7705900.cif