Crystallography Open Database

Information card for entry 7248418

Preview

Coordinates	7248418.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H26 N2 O3
Calculated formula	C32 H26 N2 O3
SMILES	O=C1[C@]2([C@H](c3ccccc3)[C@H](N[C@]32c2c(NC3=O)cccc2)Cc2ccccc2)COc2c1cccc2.O=C1[C@@]2([C@@H](c3ccccc3)[C@@H](N[C@@]32c2c(NC3=O)cccc2)Cc2ccccc2)COc2c1cccc2
Title of publication	Activity against <i>Mycobacterium tuberculosis</i> of a new class of spirooxindolopyrrolidine embedded chromanone hybrid heterocycles.
Authors of publication	Alkaltham, Manal Fahad; Almansour, Abdulrahman I.; Arumugam, Natarajan; Vagolu, Siva Krishna; Tønjum, Tone; Alaqeel, Shatha Ibrahim; Rajaratnam, Saiswaroop; Sivaramakrishnan, Venketesh
Journal of publication	RSC advances
Year of publication	2024
Journal volume	14
Journal issue	17
Pages of publication	11604 - 11613
a	8.1861 ± 0.0011 Å
b	11.0003 ± 0.0016 Å
c	14.636 ± 0.002 Å
α	76.208 ± 0.005°
β	78.404 ± 0.004°
γ	86.588 ± 0.004°
Cell volume	1253.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1243
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.0963
Weighted residual factors for all reflections included in the refinement	0.1183
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
291221 (current)	2024-04-16	cif/ Adding structures of 7248418, 7248419 via cif-deposit CGI script.	7248418.cif