Crystallography Open Database

Information card for entry 7247564

Preview

Coordinates	7247564.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Manganese-organic Compound
Formula	C17 H16 Mn0.5 N4 O3
Calculated formula	C17 H16 Mn0.5 N4 O3
Title of publication	Differential supercapacitor and Schottky diode behaviours in two new isostructural coordination polymers based on redox active metal ions
Authors of publication	Das, Chhatan; Debnath, Subhrajyoti; Patel, Vishwas D.; Gupta, Dhritiman; Banerjee, Anjan; Mahata, Partha
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	45
Pages of publication	6343 - 6353
a	7.9293 ± 0.0007 Å
b	8.574 ± 0.0007 Å
c	11.9825 ± 0.001 Å
α	81.591 ± 0.002°
β	88.173 ± 0.002°
γ	89.232 ± 0.002°
Cell volume	805.44 ± 0.12 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.087
Residual factor for significantly intense reflections	0.071
Weighted residual factors for significantly intense reflections	0.11
Weighted residual factors for all reflections included in the refinement	0.1152
Goodness-of-fit parameter for all reflections included in the refinement	1.225
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
288808 (current)	2024-01-06	cif/ Updating files of 7247564, 7247565 Original log message: Adding full bibliography for 7247564--7247565.cif.	7247564.cif
287071	2023-10-22	cif/ Adding structures of 7247564, 7247565 via cif-deposit CGI script.	7247564.cif