Crystallography Open Database

Information card for entry 7710437

Preview

Coordinates	7710437.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	N-(21,26-dihydroxynaphthalin)-C5,C17-(1-hydroxybenzol)-phenanzin-6-on
Formula	C28 H22 N2 O6
Calculated formula	C28 H22 N2 O6
Title of publication	Juglophen: a tetradentate non-innocent electron sponge naphthoquinone-imine ligand and its reduced and oxidized nickel complexes [Ni(jp)]<sup>-,0,+</sup> .
Authors of publication	Schumann, Henrik; Klein, Marius; Prinzisky, Christian; Burghaus, Olaf; Sundermeyer, Jörg
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	24
Pages of publication	9348 - 9356
a	17.9509 ± 0.0006 Å
b	12.1508 ± 0.0006 Å
c	22.0864 ± 0.0011 Å
α	90°
β	107.443 ± 0.003°
γ	90°
Cell volume	4595.9 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0933
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1054
Weighted residual factors for all reflections included in the refinement	0.1184
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
276611 (current)	2022-07-06	cif/ Updating files of 7710437, 7710438, 7710439 Original log message: Adding full bibliography for 7710437--7710439.cif.	7710437.cif
275896	2022-06-08	cif/ Adding structures of 7710437, 7710438, 7710439 via cif-deposit CGI script.	7710437.cif