Crystallography Open Database

Information card for entry 4323952

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Coordinates	4323952.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H31 B N6 O P Rh
Calculated formula	C19 H31 B N6 O P Rh
SMILES	[Rh]1([P](C)(C)C)([n]2n([BH](n3[n]1c(cc3C)C)n1nc(cc1C)C)c(cc2C)C)C#[O]
Title of publication	η2-Bonded Hydrotris(3,5-dimethylpyrazolyl)borate in [Rh(HB(Me2pz)3)(CO)(PMe3)]. X-ray Crystal Structure and Dynamic Exchange in Solution
Authors of publication	V. Chauby; C. Serra Le Berre; Ph. Kalck; J.-C. Daran; G. Commenges
Journal of publication	Inorganic Chemistry
Year of publication	1996
Journal volume	35
Pages of publication	6354 - 6355
a	16.474 Å
b	8.899 Å
c	17.058 Å
α	90°
β	110.409°
γ	90°
Cell volume	2343.76 Å³
Cell temperature	293 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0276
Weighted residual factors for significantly intense reflections	0.0293
Goodness-of-fit parameter for significantly intense reflections	1.7708
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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