Crystallography Open Database

Information card for entry 7121919

7121918 << 7121919 >> 7121920

Preview

Structure parameters

Formula	C39 H40 N2 O7
Calculated formula	C39 H40 N2 O7
Title of publication	A colorimetric and fluorometric dual-modal sensor for methanol based on a functionalized pentacenequinone derivative.
Authors of publication	Zhao, Mengting; Yue, Yuxin; Liu, Chang; Hui, Peiyi; He, Song; Zhao, Liancheng; Zeng, Xianshun
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	60
Pages of publication	8339 - 8342
a	7.035 ± 0.0017 Å
b	8.4308 ± 0.0018 Å
c	15.21 ± 0.004 Å
α	98.594 ± 0.019°
β	99.03 ± 0.02°
γ	105.311 ± 0.02°
Cell volume	841.9 ± 0.4 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.1785
Residual factor for significantly intense reflections	0.0852
Weighted residual factors for significantly intense reflections	0.2309
Weighted residual factors for all reflections included in the refinement	0.339
Goodness-of-fit parameter for all reflections included in the refinement	0.968
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7121919.html