Crystallography Open Database

Information card for entry 7133318

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Coordinates	7133318.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H54 N2 O4
Calculated formula	C64 H54 N2 O4
Title of publication	Synthesis and resolution of multi-chiral carbonyl-N embedded hetero[7]helicenes for efficient circularly polarized luminescence.
Authors of publication	Wang, Yuxiang; Liao, Qi; Feng, Yabin; Wang, Yiran; Li, Yunzhi; Meng, Qi
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	63
Pages of publication	8292 - 8295
a	13.1642 ± 0.0013 Å
b	13.1642 ± 0.0013 Å
c	48.25 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	7241.3 ± 1.4 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	169
Hermann-Mauguin space group symbol	P 61
Hall space group symbol	P 61
Residual factor for all reflections	0.1582
Residual factor for significantly intense reflections	0.0754
Weighted residual factors for significantly intense reflections	0.1612
Weighted residual factors for all reflections included in the refinement	0.2032
Goodness-of-fit parameter for all reflections included in the refinement	0.991
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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