Crystallography Open Database

Information card for entry 1519120

1519119 << 1519120 >> 1519121

Preview

Coordinates	1519120.cif

Structure parameters

Formula	C22 H18 Cl2 N4 O8 Pt
Calculated formula	C22 H18 Cl2 N4 O8 Pt
SMILES	[Pt]1([n]2c3c4[n]1cccc4ccc3ccc2)([n]1ccccc1)[n]1ccccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
Title of publication	[Pt(C22H22N4)]2(ClO4)
Authors of publication	Gillard, Robert D.; Ullah, S.M. Bashir; Malik, K.M. Abdul; Hursthouse, Michael B.; Lamond, Steven J.
Journal of publication	Crystal Structure Report Archive
Year of publication	1992
Pages of publication	865
a	8.397 ± 0.003 Å
b	27.42 ± 0.008 Å
c	10.898 ± 0.004 Å
α	90°
β	96.92 ± 0.01°
γ	90°
Cell volume	2490.9 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0331
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.1051
Weighted residual factors for all reflections included in the refinement	0.1051
Goodness-of-fit parameter for all reflections included in the refinement	1.129
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1519120.cif
135422	2015-04-29	cif/ Adding structures of 1519120 via cif-deposit CGI script.	1519120.cif