Crystallography Open Database

Information card for entry 7151309

Preview

Coordinates	7151309.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H45 Cl3 N4 O2
Calculated formula	C49 H45 Cl3 N4 O2
Title of publication	Oxidative reactions of 6-pentyl indolo[3,2-b]carbazole: formation of novel C-C and C-N coupled dimers.
Authors of publication	Gu, Rong; Van Hecke, Kristof; Van Meervelt, Luc; Toppet, Suzanne; Dehaen, Wim
Journal of publication	Organic & biomolecular chemistry
Year of publication	2006
Journal volume	4
Journal issue	20
Pages of publication	3785 - 3789
a	24.3549 ± 0.0008 Å
b	13.9993 ± 0.0004 Å
c	26.1244 ± 0.0007 Å
α	90°
β	94.689 ± 0.002°
γ	90°
Cell volume	8877.3 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
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	0.1108
Residual factor for significantly intense reflections	0.0776
Weighted residual factors for significantly intense reflections	0.1669
Weighted residual factors for all reflections included in the refinement	0.1793
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180299 (current)	2016-03-26	cif/7/15/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/15/13.	7151309.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7151309.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7151309.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7151309.cif