Crystallography Open Database

Information card for entry 7157378

Preview

Coordinates	7157378.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	1,3-bis Indole
Formula	C24 H20 N2
Calculated formula	C24 H20 N2
Title of publication	Zinc triflate catalyzed 1,3-indolylation of cyclohexanones: tandem condensation, dehydrogenation and aromatization sequence.
Authors of publication	Singh, Himanshu; Tiwari, Rajat; Sharma, Poonam; Kumar, Pramod; Jain, Nidhi
Journal of publication	Organic & biomolecular chemistry
Year of publication	2020
Journal volume	18
Journal issue	13
Pages of publication	2492 - 2500
a	15.931 ± 0.002 Å
b	14.7572 ± 0.0015 Å
c	8.0025 ± 0.0009 Å
α	90°
β	106.219 ± 0.004°
γ	90°
Cell volume	1806.5 ± 0.4 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	3
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	0.09
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1312
Weighted residual factors for all reflections included in the refinement	0.1448
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
250367 (current)	2020-04-05	cif/ Updating files of 7157378 Original log message: Adding full bibliography for 7157378.cif.	7157378.cif
249113	2020-03-06	cif/ Adding structures of 7157378 via cif-deposit CGI script.	7157378.cif