Crystallography Open Database

Information card for entry 7028050

Preview

Coordinates	7028050.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H60 B2 N8 P2 Ru
Calculated formula	C45 H60 B2 N8 P2 Ru
Title of publication	Neutral and cationic ruthenium hydrotris(pyrazolyl)borate derivatives containing bulky monodentate phosphines. Crystal structures of [RuTp(H2O)(PPri2Me)2][CF3SO3]·EtOH and [RuTp(N2)(PEt3)2][BPh4]
Authors of publication	Tenorio, Miguel A. Jiménez; Jiménez Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1998
Journal issue	21
Pages of publication	3601
a	15.908 ± 0.004 Å
b	22.077 ± 0.006 Å
c	13.204 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	4637 ± 3 Å³
Cell temperature	290.2 K
Ambient diffraction temperature	290.2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for significantly intense reflections	0.0658
Weighted residual factors for significantly intense reflections	0.0768
Goodness-of-fit parameter for significantly intense reflections	2.245
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7028050.cif
97564	2014-01-29	cif/ Adding structures of 7028049, 7028050 via cif-deposit CGI script.	7028050.cif