Crystallography Open Database

Information card for entry 4304469

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Coordinates	4304469.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H21 F3 N3 O5 Re
Calculated formula	C24 H39 F5 N5 O7 Re
Title of publication	Assessment of Macrocyclic Triamine Ligands As Synthons for Organometallic 99mTc Radiopharmaceuticals
Authors of publication	Keisuke Suzuki; Naomi Shimmura; Khajadpai Thipyapong; Tomoya Uehara; Hiromichi Akizawa; Yasushi Arano
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	2593 - 2600
a	15.383 ± 0.001 Å
b	8.612 ± 0.001 Å
c	13.902 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	1841.7 ± 0.3 Å³
Cell temperature	298.2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for significantly intense reflections	0.0394
Weighted residual factors for all reflections included in the refinement	0.0545
Goodness-of-fit parameter for all reflections included in the refinement	1.412
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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