Crystallography Open Database

Information card for entry 7121488

Preview

Coordinates	7121488.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H58 Al N3 O3
Calculated formula	C50 H58 Al N3 O3
Title of publication	A salen-Al/carbazole dyad-based guest-host assembly: enhancement of luminescence efficiency via intramolecular energy transfer.
Authors of publication	Kwak, Sang Woo; Jin, Hyomin; Shin, Heuiseok; Lee, Ji Hye; Hwang, Hyonseok; Lee, Junseong; Kim, Min; Chung, Yongseog; Kim, Youngjo; Lee, Kang Mun; Park, Myung Hwan
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	37
Pages of publication	4712 - 4715
a	9.9221 ± 0.0003 Å
b	22.0031 ± 0.0006 Å
c	20.2879 ± 0.0005 Å
α	90°
β	101.001 ± 0.0017°
γ	90°
Cell volume	4347.8 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.203
Residual factor for significantly intense reflections	0.0864
Weighted residual factors for significantly intense reflections	0.1791
Weighted residual factors for all reflections included in the refinement	0.232
Goodness-of-fit parameter for all reflections included in the refinement	0.983
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
228036 (current)	2019-11-17	cif/ Updating files of 7121488 Original log message: Adding full bibliography for 7121488.cif.	7121488.cif
207323	2018-04-13	cif/ Adding structures of 7121488 via cif-deposit CGI script.	7121488.cif