Crystallography Open Database

Information card for entry 7234449

Preview

Coordinates	7234449.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H21 N3 O2
Calculated formula	C23 H21 N3 O2
SMILES	c12c3c(cccc3c(cc1)N1CCCCC1)C(=O)N(C2=O)Cc1ccccn1
Title of publication	Fluorescent crystals and co-crystals of 1,8-naphthalimide derivatives: synthesis, structure determination and photophysical characterization
Authors of publication	F. Grepioni; S. d'Agostino; D. Braga; A. Bertocco; L. Catalano; B. Ventura
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	9425 - 9434
a	15.4693 ± 0.0008 Å
b	7.186 ± 0.0003 Å
c	17.5613 ± 0.0008 Å
α	90°
β	111.307 ± 0.005°
γ	90°
Cell volume	1818.72 ± 0.16 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 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	0.1026
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.1112
Weighted residual factors for all reflections included in the refinement	0.1368
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
219153 (current)	2019-10-08	cif/ Adding structures of 7234449, 7234450, 7234451, 7234452, 7234453, 7234454, 7234455 via cif-deposit CGI script.	7234449.cif