Crystallography Open Database

Information card for entry 4514476

Preview

Coordinates	4514476.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H66 Mn6 N6 O43 P6
Calculated formula	C92 H66 Mn6 N6 O43 P6
Title of publication	Facile Fabrication of a Multifunctional Metal-Organic Framework-based Sensor Exhibiting Exclusive Solvochromic Behaviors toward Ketone Molecules.
Authors of publication	Li, Bao; Chen, Xi; Hu, Peng; Kirchon, Angelo; Zhao, Yu-Meng; Pang, Jiandong; Zhang, Tianle; Zhou, Hong-Cai
Journal of publication	ACS applied materials & interfaces
Year of publication	2019
Journal volume	11
Journal issue	8
Pages of publication	8227 - 8233
a	21.0921 ± 0.0011 Å
b	28.4208 ± 0.0008 Å
c	34.8069 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	20865.1 ± 1.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.1215
Residual factor for significantly intense reflections	0.0722
Weighted residual factors for significantly intense reflections	0.1828
Weighted residual factors for all reflections included in the refinement	0.2024
Goodness-of-fit parameter for all reflections included in the refinement	0.837
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
219664 (current)	2019-10-28	cif/ Adding structures of 4514475, 4514476 via cif-deposit CGI script.	4514476.cif