Crystallography Open Database

Information card for entry 7015515

Preview

Coordinates	7015515.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H41 B Br N P2 Pt Si2
Calculated formula	C20 H41 B Br N P2 Pt Si2
SMILES	[Pt](Br)([P](C)(C)C)([P](C)(C)C)C1B(C=1c1ccccc1)N([Si](C)(C)C)[Si](C)(C)C
Title of publication	Reactivity of a platinum-substituted borirene.
Authors of publication	Braunschweig, Holger; Ye, Qing; Radacki, Krzystof; Kupfer, Thomas
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	14
Pages of publication	3666 - 3670
a	8.9084 ± 0.0005 Å
b	21.5491 ± 0.0011 Å
c	15.4872 ± 0.0008 Å
α	90°
β	106.388 ± 0.002°
γ	90°
Cell volume	2852.3 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0262
Residual factor for significantly intense reflections	0.021
Weighted residual factors for significantly intense reflections	0.0461
Weighted residual factors for all reflections included in the refinement	0.0481
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7015515.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7015515.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7015515.cif
21179	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7015513, 7015514, 7015515 via cif-deposit CGI script.	7015515.cif