Crystallography Open Database

Information card for entry 7238715

Preview

Coordinates	7238715.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H24 Br N3 O5
Calculated formula	C24 H24 Br N3 O5
Title of publication	Synthesis of carbohydrate-based naphthoquinones and their substituted phenylhydrazono derivatives as anticancer agents
Authors of publication	Campos, Vinicius R.; Santos, Evelyne A. dos; Ferreira, Vitor F.; Montenegro, Raquel C.; de Souza, Maria C. B. V.; Costa-Lotufo, Letícia V.; de Moraes, Manoel O.; Regufe, Anna K. P.; Jordão, Alessandro K.; Pinto, Angelo C.; Resende, Jackson A. L. C.; Cunha, Anna C.
Journal of publication	RSC Advances
Year of publication	2012
Journal volume	2
Journal issue	30
Pages of publication	11438
a	5.1446 ± 0.0003 Å
b	13.3386 ± 0.001 Å
c	33.974 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2331.4 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0719
Residual factor for significantly intense reflections	0.0529
Weighted residual factors for significantly intense reflections	0.1243
Weighted residual factors for all reflections included in the refinement	0.1332
Goodness-of-fit parameter for all reflections included in the refinement	1.105
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
244312 (current)	2019-11-28	cif/ Adding structures of 7238714, 7238715 via cif-deposit CGI script.	7238715.cif