Crystallography Open Database

Information card for entry 1543270

Preview

Coordinates	1543270.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	5,10-dimethyl-5,10-dihydroindolo[3,2-b]indole
Chemical name	;Indoloindole;
Formula	C16 H14 N2
Calculated formula	C16 H14 N2
Title of publication	N-Methyl Transfer Induced Copper-Mediated Oxidative Diamination of Alkynes.
Authors of publication	Ho, Hon Eong; Oniwa, Kazuaki; Yamamoto, Yoshinori; Jin, Tienan
Journal of publication	Organic letters
Year of publication	2016
Journal volume	18
Journal issue	10
Pages of publication	2487 - 2490
a	13.8715 ± 0.0006 Å
b	5.5938 ± 0.0002 Å
c	17.2693 ± 0.001 Å
α	90°
β	113.43 ± 0.0014°
γ	90°
Cell volume	1229.51 ± 0.1 Å³
Cell temperature	300 K
Ambient diffraction temperature	300 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0754
Residual factor for significantly intense reflections	0.0588
Weighted residual factors for significantly intense reflections	0.1768
Weighted residual factors for all reflections included in the refinement	0.1908
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
184958 (current)	2016-08-05	cif/ Updating files of 1543270 Original log message: Adding full bibliography for 1543270.cif.	1543270.cif
182818	2016-05-07	cif/ Adding structures of 1543270 via cif-deposit CGI script.	1543270.cif