Crystallography Open Database

Information card for entry 7235435

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Coordinates	7235435.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H46 N2 O6
Calculated formula	C42 H46 N2 O6
Title of publication	New semiconducting naphthalene bisimides N-substituted with alkoxyphenyl groups: spectroscopic, electrochemical, structural and electrical properties
Authors of publication	Rybakiewicz, Renata; Tszydel, Izabela; Zapala, Joanna; Skorka, Lukasz; Wamil, Damian; Djurado, David; Pécaut, Jacques; Ulanski, Jacek; Zagorska, Malgorzata; Pron, Adam
Journal of publication	RSC Adv.
Year of publication	2014
Journal volume	4
Journal issue	27
Pages of publication	14089
a	5.2267 ± 0.0005 Å
b	7.617 ± 0.0005 Å
c	22.3732 ± 0.0018 Å
α	96.434 ± 0.006°
β	95.114 ± 0.007°
γ	100.318 ± 0.007°
Cell volume	865.34 ± 0.13 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1763
Residual factor for significantly intense reflections	0.079
Weighted residual factors for significantly intense reflections	0.1207
Weighted residual factors for all reflections included in the refinement	0.1554
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
233029 (current)	2019-11-23	cif/ Adding structures of 7235433, 7235434, 7235435 via cif-deposit CGI script.	7235435.cif