Crystallography Open Database

Information card for entry 4085260

Preview

Coordinates	4085260.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H62 Ag B F4 N4
Calculated formula	C48 H62 Ag B F4 N4
SMILES	[Ag](=C1N(CCN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)=C1N(C=CN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C.[B](F)(F)(F)[F-]
Title of publication	Synthesis of Homoleptic and Heteroleptic Bis-N-heterocylic Carbene Group 11 Complexes
Authors of publication	Lazreg, Faïma; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	2
Pages of publication	419
a	17.0015 ± 0.0011 Å
b	20.0677 ± 0.0008 Å
c	23.3459 ± 0.0017 Å
α	72.428 ± 0.006°
β	84.524 ± 0.008°
γ	65.788 ± 0.006°
Cell volume	6921.8 ± 0.8 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 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 significantly intense reflections	0.1064
Weighted residual factors for all reflections included in the refinement	0.3037
Goodness-of-fit parameter for all reflections included in the refinement	1.156
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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