Crystallography Open Database

Information card for entry 7246164

Preview

Coordinates	7246164.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H24 N O
Calculated formula	C20 H24 N O
SMILES	Oc1c(cccc1/C=N/C12CC3CC(C1)CC(C3)C2)CC=C
Title of publication	Synthesis of an amantadine-based novel Schiff base and its transition metal complexes as potential ALP, α-amylase, and α-glucosidase inhibitors
Authors of publication	Ajaz, Aliya; Shaheen, Muhammad Ashraf; Ahmed, Maqsood; Munawar, Khurram Shahzad; Siddique, Abu Bakar; Karim, Abdul; Ahmad, Nazir; Rehman, Muhammad Fayyaz ur
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	5
Pages of publication	2756 - 2767
a	7.0706 ± 0.0015 Å
b	18.748 ± 0.004 Å
c	12.612 ± 0.003 Å
α	90°
β	105.578 ± 0.005°
γ	90°
Cell volume	1610.4 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	7
Hermann-Mauguin space group symbol	P 1 c 1
Hall space group symbol	P -2yc
Residual factor for all reflections	0.2849
Residual factor for significantly intense reflections	0.1437
Weighted residual factors for significantly intense reflections	0.3506
Weighted residual factors for all reflections included in the refinement	0.4384
Goodness-of-fit parameter for all reflections included in the refinement	1.258
Diffraction radiation probe	x-ray
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
280429 (current)	2023-01-19	cif/ Adding structures of 7246164, 7246165 via cif-deposit CGI script.	7246164.cif