Crystallography Open Database

Information card for entry 7247213

Preview

Coordinates	7247213.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H17 N
Calculated formula	C23 H17 N
SMILES	n1c2c3c(cccc3)CCc2c(c2c1cccc2)c1ccccc1
Title of publication	Metal-free reusable hollow-spherical triazine microporous organic polymer supported quinolines synthesis via hydrogen evolution
Authors of publication	Pathak, Debabrat; Kalita, Bikash Kumar; Sarmah, Ashish; Sharma, Himanshu; Bora, Bidisha; Goswami, Tridib K.; Sarma, Bipul
Journal of publication	Green Chemistry
Year of publication	2023
Journal volume	25
Journal issue	19
Pages of publication	7642 - 7652
a	14.183 ± 0.003 Å
b	12.855 ± 0.003 Å
c	8.8411 ± 0.0019 Å
α	90°
β	98.111 ± 0.006°
γ	90°
Cell volume	1595.8 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0659
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.1037
Weighted residual factors for all reflections included in the refinement	0.1161
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
286752 (current)	2023-10-06	cif/ Updating files of 7247212, 7247213, 7247214 Original log message: Adding full bibliography for 7247212--7247214.cif.	7247213.cif
285780	2023-08-16	cif/ Adding structures of 7247212, 7247213, 7247214 via cif-deposit CGI script.	7247213.cif