Crystallography Open Database

Information card for entry 4338291

Preview

Coordinates	4338291.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C208 H96 Cl4 Mn4 N16 O72 Zn16
Calculated formula	C208 H80 Cl4 Mn4 N16 O72 Zn16
Title of publication	Metalloporphyrinic framework containing multiple pores for highly efficient and selective epoxidation.
Authors of publication	Yang, Xiu-Li; Wu, Chuan-De
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	10
Pages of publication	4797 - 4799
a	30.4589 ± 0.0008 Å
b	30.4589 ± 0.0008 Å
c	44.287 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	41087 ± 4 Å³
Cell temperature	135 ± 2 K
Ambient diffraction temperature	135 ± 2 K
Number of distinct elements	7
Space group number	140
Hermann-Mauguin space group symbol	I 4/m c m
Hall space group symbol	-I 4 2c
Residual factor for all reflections	0.1919
Residual factor for significantly intense reflections	0.1304
Weighted residual factors for significantly intense reflections	0.2537
Weighted residual factors for all reflections included in the refinement	0.2771
Goodness-of-fit parameter for all reflections included in the refinement	1.116
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
179485 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/82.	4338291.cif
115679	2014-06-05	cif/ Updating files of 4338291 Original log message: Adding full bibliography for 4338291.cif.	4338291.cif
112628	2014-05-03	cif/ Adding structures of 4338291 via cif-deposit CGI script.	4338291.cif