Crystallography Open Database

Information card for entry 7059045

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Coordinates	7059045.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	3,3-disubstituted oxindole
Formula	C27 H22 Br N3 O4 S
Calculated formula	C27 H22 Br N3 O4 S
Title of publication	Brønsted acid catalysed eco friendly synthesis of quaternary centred C-3 functionalized oxindole derivatives
Authors of publication	Poomathi, Nataraj; Balaji, Ravichandran; Maheswari, Narayanan Uma; Mathivanan, Narayanasamy; Perumal, Paramasivan T.; Balasubramanian, Kalpattu K.; Barathi, Veluchamy Amutha; Ramakrishna, Seeram
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	18
Pages of publication	14817
a	14.158 ± 0.003 Å
b	14.747 ± 0.003 Å
c	23.048 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	4812 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1138
Residual factor for significantly intense reflections	0.0904
Weighted residual factors for significantly intense reflections	0.2816
Weighted residual factors for all reflections included in the refinement	0.3003
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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
227889 (current)	2019-11-15	cif/ Adding structures of 7059045 via cif-deposit CGI script.	7059045.cif