Crystallography Open Database

Information card for entry 7156742

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Coordinates	7156742.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H25 Cl N4 O2 S
Calculated formula	C28 H25 Cl N4 O2 S
Title of publication	A facile one pot synthesis of thiazolo[3,2-a]benzimidazole and pyran fused polyheterocyclic scaffolds.
Authors of publication	Mariappan, Arumugam; Rajaguru, Kandasamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	17
Pages of publication	4196 - 4199
a	23.3244 ± 0.0007 Å
b	9.7484 ± 0.0003 Å
c	23.6714 ± 0.0007 Å
α	90°
β	107.472 ± 0.002°
γ	90°
Cell volume	5134 ± 0.3 Å³
Cell temperature	99.99 K
Ambient diffraction temperature	99.99 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0746
Residual factor for significantly intense reflections	0.0549
Weighted residual factors for significantly intense reflections	0.1081
Weighted residual factors for all reflections included in the refinement	0.1168
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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