Crystallography Open Database

Information card for entry 4314410

Preview

Coordinates	4314410.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H30 I2 O P2 Pt
Calculated formula	C36 H30 I2 O P2 Pt
Title of publication	Cooperation between Cis and Trans Influences in cis-PtII(PPh3)2 Complexes: Structural, Spectroscopic, and Computational Studies
Authors of publication	Luca Rigamonti; Alessandra Forni; Mario Manassero; Carlo Manassero; Alessandro Pasini
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	123 - 135
a	9.8799 ± 0.0005 Å
b	10.5936 ± 0.0006 Å
c	17.8664 ± 0.0009 Å
α	86.69 ± 0.001°
β	78.11 ± 0.001°
γ	69.88 ± 0.001°
Cell volume	1718 ± 0.16 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.059
Residual factor for significantly intense reflections	0.059
Weighted residual factors for significantly intense reflections	0.096
Goodness-of-fit parameter for all reflections	0.986
Goodness-of-fit parameter for significantly intense reflections	0.986
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	Mo-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179218 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/44.	4314410.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4314410.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4314410.cif
7518	2011-02-02	../uploads/cif-deposit/cod/cif Adding structures of 4314410 via cif-deposit CGI script.	4314410.cif