Crystallography Open Database

Information card for entry 7159731

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Coordinates	7159731.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H28 F6 N6
Calculated formula	C46 H28 F6 N6
Title of publication	Substituent-controlled regioselective arylation of carbazoles using dual catalysis.
Authors of publication	Shahid, M.; Muthuraja, Perumal; Gopinath, Purushothaman
Journal of publication	Organic & biomolecular chemistry
Year of publication	2024
Journal volume	22
Journal issue	4
Pages of publication	753 - 758
a	19.4774 ± 0.0017 Å
b	12.0444 ± 0.0011 Å
c	16.5411 ± 0.0015 Å
α	90°
β	106.097 ± 0.003°
γ	90°
Cell volume	3728.3 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
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	0.0913
Residual factor for significantly intense reflections	0.0564
Weighted residual factors for significantly intense reflections	0.1309
Weighted residual factors for all reflections included in the refinement	0.1589
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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