Crystallography Open Database

Information card for entry 4514932

Preview

Coordinates	4514932.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H33 N O2
Calculated formula	C42 H33 N O2
Title of publication	1,8-Naphthalimide-Based Highly Emissive Luminophors with Various Mechanofluorochromism and Aggregation-Induced Characteristics.
Authors of publication	Yin, Ya; Chen, Zhao; Fan, Congbin; Liu, Gang; Pu, Shouzhi
Journal of publication	ACS omega
Year of publication	2019
Journal volume	4
Journal issue	10
Pages of publication	14324 - 14332
a	9.5161 ± 0.0012 Å
b	30.572 ± 0.004 Å
c	13.2584 ± 0.0012 Å
α	90°
β	125.371 ± 0.006°
γ	90°
Cell volume	3145.3 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.1797
Residual factor for significantly intense reflections	0.0514
Weighted residual factors for significantly intense reflections	0.0733
Weighted residual factors for all reflections included in the refinement	0.0961
Goodness-of-fit parameter for all reflections included in the refinement	0.892
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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