Crystallography Open Database

Information card for entry 7100062

Preview

Coordinates	7100062.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	t-butyl-calix[4]arene*2(Zn(n-butylamine)3) 2Cl
Formula	C36 H66.11 Cl1.16 N3.5 O2.5 Zn
Calculated formula	C36 H66.11 Cl1.16 N3.5 O2.5 Zn
Title of publication	Extending the chemistry of p-t-butylcalix[4]arene with H-bonding and secondary coordination
Authors of publication	John Ripmeester; Philip Brown; Gary D. Enright; Konstantin A. Udachin
Journal of publication	Chemical Communications
Year of publication	2005
a	12.5854 ± 0.0015 Å
b	16.2134 ± 0.0019 Å
c	20.695 ± 0.002 Å
α	77.408 ± 0.002°
β	86.846 ± 0.002°
γ	79.32 ± 0.002°
Cell volume	4049.5 ± 0.8 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

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