Table 2. Experimental details.

Crystal data
Chemical formula	[Zr(C2H7N)2(C2H6N)3]I
M r	440.52
Crystal system, space group	Orthorhombic, P b c a
Temperature (K)	100
a, b, c (Å)	14.2425 (3), 15.4113 (3), 16.8537 (3)
V (Å3)	3699.31 (12)
Z	8
Radiation type	Mo Kα
μ (mm−1)	2.26
Crystal size (mm)	0.2 × 0.1 × 0.1
Data collection
Diffractometer	Bruker APEXII CCD
Absorption correction	Numerical (SADABS; Bruker, 2014 ▸)
T min, T max	0.656, 0.745
No. of measured, independent and observed [I > 2σ(I)] reflections	29665, 3620, 3319
R int	0.027
(sin θ/λ)max (Å−1)	0.617
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S	0.015, 0.036, 1.07
No. of reflections	3620
No. of parameters	154
H-atom treatment	H-atom parameters constrained
Δρmax, Δρmin (e Å−3)	0.33, −0.34

Computer programs: APEX2 and SAINT (Bruker, 2013 ▸), SHELXS and SHELXL (Sheldrick, 2008 ▸), OLEX2 (Dolomanov et al., 2009 ▸), Mercury (Macrae et al., 2006 ▸) and publCIF (Westrip, 2010 ▸).