Crystallography Open Database

Information card for entry 7106356

Preview

Coordinates	7106356.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H41.5 Cd1.25 N6 O11 Pd
Calculated formula	C48 H24 Cd1.25 N4 O8.5 Pd
Title of publication	A metalloporphyrin functionalized metal-organic framework for selective oxidization of styrene
Authors of publication	Ming-Hua Xie; Xiu-Li Yang; Chuan-De Wu
Journal of publication	Chem.Commun.
Year of publication	2011
Journal volume	47
Pages of publication	5521
a	7.2953 ± 0.0001 Å
b	25.5761 ± 0.0007 Å
c	30.7597 ± 0.0006 Å
α	90°
β	96.361 ± 0.002°
γ	90°
Cell volume	5704 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0852
Residual factor for significantly intense reflections	0.0776
Weighted residual factors for significantly intense reflections	0.1837
Weighted residual factors for all reflections included in the refinement	0.1904
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
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/7106356.html