Crystallography Open Database

Information card for entry 7242788

Preview

Coordinates	7242788.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H36 N8 O10
Calculated formula	C36 H36 N8 O10
Title of publication	A two-component molecular hybrid with enhanced emission characteristics and mechanoresponsive luminescence properties
Authors of publication	Liu, Jian-Jun; Xia, Shu-Biao; Liu, Teng; Liu, Jia-Ming; Cheng, Fei-Xiang
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	24
Pages of publication	4320 - 4326
a	12.8477 ± 0.0015 Å
b	10.4635 ± 0.0011 Å
c	26.812 ± 0.003 Å
α	90°
β	93.96 ± 0.002°
γ	90°
Cell volume	3595.8 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0933
Residual factor for significantly intense reflections	0.0576
Weighted residual factors for significantly intense reflections	0.1389
Weighted residual factors for all reflections included in the refinement	0.1618
Goodness-of-fit parameter for all reflections included in the refinement	1.022
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
267107 (current)	2021-07-05	cif/ Updating files of 7242788, 7242789 Original log message: Adding full bibliography for 7242788--7242789.cif.	7242788.cif
265050	2021-05-08	cif/ Adding structures of 7242788, 7242789 via cif-deposit CGI script.	7242788.cif