Crystallography Open Database

Information card for entry 7220365

7220364 << 7220365 >> 7220366

Preview

Coordinates	7220365.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H16 Ag B0.5 Cl0.5 F2 N2 O7 Pd
Calculated formula	C13 H16 Ag B0.5 Cl0.5 F2 N2 O7 Pd
Title of publication	Crosslinking of the Pd(acacCN)2building unit with Ag(i) salts: dynamic 1D polymers and an extended 3D network
Authors of publication	Guo, Qianqian; Merkens, Carina; Si, Runze; Englert, Ulli
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	23
Pages of publication	4383
a	11.684 ± 0.0011 Å
b	17.2956 ± 0.0016 Å
c	9.1223 ± 0.0009 Å
α	90°
β	98.158 ± 0.002°
γ	90°
Cell volume	1824.8 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0519
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0992
Weighted residual factors for all reflections included in the refinement	0.1063
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
176429 (current)	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	7220365.cif
138551	2015-06-07	cif/ Updating files of 7220357, 7220358, 7220359, 7220360, 7220361, 7220362, 7220363, 7220364, 7220365 Original log message: Adding full bibliography for 7220357--7220365.cif.	7220365.cif
135838	2015-05-09	cif/ Adding structures of 7220357, 7220358, 7220359, 7220360, 7220361, 7220362, 7220363, 7220364, 7220365 via cif-deposit CGI script.	7220365.cif