Crystallography Open Database

Information card for entry 2214225

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Coordinates	Coordinates are not available: file is not found.
Structure factors	2214225.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	Bis(5-aminoisoquinoline)diazidozinc(II)
Formula	C18 H16 N10 Zn
Calculated formula	C18 H16 N10 Zn
SMILES	[Zn](N=N#N)(N=N#N)([n]1cc2cccc(c2cc1)N)[n]1ccc2c(cccc2c1)N
Title of publication	Bis(5-aminoisoquinoline)diazidozinc(II)
Authors of publication	Zhi-Xin Miao; Min Shao; Ming-Xing Li
Journal of publication	Acta Crystallographica Section E
Year of publication	2007
Journal volume	63
Journal issue	7
Pages of publication	m1808 - m1808
a	14.433 ± 0.0004 Å
b	16.0837 ± 0.0004 Å
c	16.4677 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	3822.75 ± 0.18 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0459
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for significantly intense reflections	0.068
Weighted residual factors for all reflections included in the refinement	0.0765
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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