Crystallography Open Database

Information card for entry 7122527

Preview

Coordinates	7122527.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H74 N6 O8
Calculated formula	C58 H74 N6 O8
Title of publication	Synthesis of d-(+)-camphor-based <i>N</i>-acylhydrazones and their antiviral activity.
Authors of publication	Kovaleva, Kseniya S.; Zubkov, Fedor I.; Bormotov, Nikolay I.; Novikov, Roman A.; Dorovatovskii, Pavel V.; Khrustalev, Victor N.; Gatilov, Yuriy V.; Zarubaev, Vladimir V.; Yarovaya, Olga I.; Shishkina, Larisa N.; Salakhutdinov, Nariman F.
Journal of publication	MedChemComm
Year of publication	2018
Journal volume	9
Journal issue	12
Pages of publication	2072 - 2082
a	10.949 ± 0.002 Å
b	15.752 ± 0.003 Å
c	31.273 ± 0.006 Å
α	90°
β	98.92 ± 0.03°
γ	90°
Cell volume	5328.4 ± 1.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0975
Residual factor for significantly intense reflections	0.0751
Weighted residual factors for significantly intense reflections	0.1601
Weighted residual factors for all reflections included in the refinement	0.1779
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation wavelength	0.80246 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
230143 (current)	2019-11-17	cif/ Updating files of 7122525, 7122526, 7122527 Original log message: Adding full bibliography for 7122525--7122527.cif.	7122527.cif
211676	2018-10-27	cif/ Adding structures of 7122525, 7122526, 7122527 via cif-deposit CGI script.	7122527.cif