Crystallography Open Database

Information card for entry 2000617

2000616 << 2000617 >> 2000618

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Coordinates	2000617.cif
Original IUCr paper	HTML

Structure parameters

Formula	C13 H32 Co F12 N4 Na O16 S4
Calculated formula	C13 H32 Co F12 N4 Na O16 S4
SMILES	C1CC[N]23[Co]([NH2]1)([OH2])([OH2])([NH2]CCC3)[NH2]CCC2.[Na]1(OS(=O)(=[O]1)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)[OH2].O
Title of publication	Structure of diaqua[tris(3-aminopropyl)amine]cobalt(III) aquatetrakis(trifluoromethanesulfonato)sodate(I) monohydrate
Authors of publication	Rawji, G. H.; Lynch, V. M.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	9
Pages of publication	1667 - 1669
a	13.2099 ± 0.0009 Å
b	12.1272 ± 0.0012 Å
c	21.847 ± 0.002 Å
α	90°
β	107.4 ± 0.006°
γ	90°
Cell volume	3339.7 ± 0.5 Å³
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	Mo
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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