Crystallography Open Database

Information card for entry 4083711

Preview

Coordinates	4083711.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	jdp_iv_119
Chemical name	jdp_iv_119
Formula	C14 H22 N4 O3 Pt
Calculated formula	C14 H22 N4 O3 Pt
SMILES	C[Pt]12(C)([n]3c(C)cc(C)n3C(C(=O)O2)n2c(cc(C)[n]12)C)O
Title of publication	Methylplatinum(II) and Molecular Oxygen: Oxidation to Methylplatinum(IV) in Competition with Methyl Group Transfer To Form Dimethylplatinum(IV)
Authors of publication	Prantner, Jason D.; Kaminsky, Werner; Goldberg, Karen I.
Journal of publication	Organometallics
Year of publication	2014
Pages of publication	140619124045007
a	8.0128 ± 0.0005 Å
b	10.3613 ± 0.0007 Å
c	10.3767 ± 0.0007 Å
α	76.447 ± 0.003°
β	88.033 ± 0.003°
γ	67.932 ± 0.003°
Cell volume	774.78 ± 0.09 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0143
Residual factor for significantly intense reflections	0.0131
Weighted residual factors for significantly intense reflections	0.0297
Weighted residual factors for all reflections included in the refinement	0.03
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
178726 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/37.	4083711.cif
126004	2014-10-30	cod/ (saulius@kolibris) Adding full bibliographies to the recently deposited structures from RSS feeds.	4083711.cif
117904	2014-06-20	cif/ Adding structures of 4083709, 4083710, 4083711 via cif-deposit CGI script.	4083711.cif