Crystallography Open Database

Information card for entry 4020250

4020249 << 4020250 >> 4020251

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Coordinates	4020250.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46.5 H63 F6 N4 O13.5 P
Calculated formula	C45 H52 F6 N4 O13 P
Title of publication	Cryptands, Powerful Hosts for Paraquat Derivatives
Authors of publication	Feihe Huang; Karen A. Switek; Lev N. Zakharov; Frank R. Fronczek; Carla Slebodnick; Matthew Lam; James A. Golen; William S. Bryant; Philip E. Mason; Arnold L. Rheingold; Ashraf-Khorassani, Mehdi; Harry W. Gibson
Journal of publication	Journal of Organic Chemistry
Year of publication	2005
Journal volume	70
Pages of publication	3231 - 3241
a	10.3991 ± 0.0006 Å
b	13.6159 ± 0.0008 Å
c	19.3423 ± 0.0012 Å
α	87.759 ± 0.001°
β	82.524 ± 0.001°
γ	72.675 ± 0.001°
Cell volume	2592.3 ± 0.3 Å³
Cell temperature	218 ± 2 K
Ambient diffraction temperature	218 ± 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	No
Has F_obs	No

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