Crystallography Open Database

Information card for entry 7704450

Preview

Coordinates	7704450.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H26 N4 O5.5 Zn
Calculated formula	C31 H26 N4 O5.5 Zn
Title of publication	Photochromism of metal-organic frameworks based on carbazole-dicarboxylic acid and bipyridine: sensing adjustment by controlling strut-to-strut energy transfer.
Authors of publication	Liu, Han; Fan, Yanru; Li, Xiao; Gao, Kuan; Li, Huijie; Yang, Yisen; Meng, Xiangru; Wu, Jie; Hou, Hongwei
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	23
Pages of publication	7952 - 7958
a	10.4072 ± 0.0008 Å
b	11.4334 ± 0.0008 Å
c	12.9954 ± 0.0009 Å
α	99.827 ± 0.003°
β	98.033 ± 0.003°
γ	113.779 ± 0.002°
Cell volume	1356.48 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.056
Residual factor for significantly intense reflections	0.0471
Weighted residual factors for significantly intense reflections	0.1299
Weighted residual factors for all reflections included in the refinement	0.1362
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
253919 (current)	2020-07-06	cif/ Updating files of 7704450, 7704451 Original log message: Adding full bibliography for 7704450--7704451.cif.	7704450.cif
252197	2020-05-20	cif/ Adding structures of 7704450, 7704451 via cif-deposit CGI script.	7704450.cif