Crystallography Open Database

Information card for entry 1512670

Preview

Coordinates	1512670.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H13 N3 O6 Pt
Calculated formula	C8 H13 N3 O6 Pt
SMILES	c1(ccccc1N(=O)=O)C1C(=O)O[Pt]([NH3])([NH3])O1.O
Title of publication	Synthesis and photoactivity of a Pt(II) complex based on an o-nitrobenzyl-derived ligand
Authors of publication	Di Liu; Jialiu Ma; Wen Zhou; Weijiang He; Zijian Guo
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	393
Pages of publication	198 - 203
a	12.6642 ± 0.0011 Å
b	7.3361 ± 0.0007 Å
c	13.6712 ± 0.0012 Å
α	90°
β	108.313 ± 0.001°
γ	90°
Cell volume	1205.81 ± 0.19 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
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	0.0496
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0751
Weighted residual factors for all reflections included in the refinement	0.0835
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
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.	1512670.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512670.cif
90730	2013-11-18	cif/ Adding structures of 1512670 via cif-deposit CGI script.	1512670.cif