Crystallography Open Database

Information card for entry 7060860

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Coordinates	7060860.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H10 N3 O3
Calculated formula	C14 H10 N3 O3
SMILES	O=C1NC(Nc2c1cccc2)c1ccccc1N(=O)=O
Title of publication	Probing the catalytic activity of highly efficient sulfonic acid fabricated cobalt ferrite magnetic nanoparticles for the clean and scalable synthesis of dihydro, spiro and bis quinazolinones
Authors of publication	Yadav, Priyanka; Awasthi, Satish K.
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	35
Pages of publication	15928 - 15941
a	20.0038 ± 0.0009 Å
b	10.8076 ± 0.0004 Å
c	12.432 ± 0.0005 Å
α	90°
β	109.818 ± 0.001°
γ	90°
Cell volume	2528.53 ± 0.18 Å³
Ambient diffraction temperature	295.4 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1247
Residual factor for significantly intense reflections	0.0811
Weighted residual factors for significantly intense reflections	0.2319
Weighted residual factors for all reflections included in the refinement	0.2802
Goodness-of-fit parameter for all reflections included in the refinement	1.3032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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